data_2l0i_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 2l0i _Structure_validation_residue.Date_analyzed 2016-10-07 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 ' 7' ' ' GLN . . . . . 0.431 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 14.0 pt20 . . . . . 0 N--CA 1.462 0.159 0 N-CA-C 111.849 0.314 . . . . 3.17 111.849 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -82.87 -43.49 16.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.132 0.492 . . . . 1.44 110.083 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.77 -40.27 87.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.499 -0.773 . . . . 1.38 112.396 -179.244 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 19.4 m -65.13 -37.72 88.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.692 0.282 . . . . 1.95 111.632 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.495 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 16.8 mmmt -69.36 -33.88 73.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.698 -0.228 . . . . 1.78 111.124 -179.286 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.3 mt -66.58 -23.86 66.26 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.947 0.404 . . . . 2.19 111.277 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -98.05 2.98 49.34 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.235 -0.439 . . . . 1.96 111.841 -179.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.4 p -120.37 15.39 12.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.026 0.441 . . . . 2.11 111.059 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 69.7 mt -97.05 165.73 11.93 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.371 0.605 . . . . 1.63 111.674 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.439 ' HG2' ' N ' ' A' ' 17' ' ' ASP . 35.3 tt0 -134.09 166.94 21.57 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.198 -1.038 . . . . 2.16 108.198 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.439 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 6.0 p-10 -72.77 5.83 2.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.815 0.34 . . . . 1.94 111.293 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.9 t -84.26 139.67 32.18 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.474 -0.33 . . . . 1.89 110.422 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -62.0 -33.02 73.56 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.166 -0.47 . . . . 3.13 110.306 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.02 -28.45 69.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.791 -0.641 . . . . 2.99 110.165 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 t -81.26 -53.47 6.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.924 -0.58 . . . . 1.62 110.606 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.0 mm -56.66 -43.34 78.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.389 -0.368 . . . . 1.52 110.86 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.6 t -60.88 -35.19 75.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 1.63 111.113 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.6 m -64.05 -32.98 74.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.267 -0.424 . . . . 1.4 111.934 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -90.84 -35.73 14.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.87 0.367 . . . . 1.14 110.869 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 22.4 t -62.74 -49.34 75.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.114 -0.493 . . . . 1.62 110.664 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.41 -22.6 67.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 2.76 110.638 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.488 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 62.1 t90 -78.91 -32.36 45.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.924 -0.58 . . . . 1.14 109.865 179.113 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 11.5 tp -81.88 -36.83 27.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.917 -0.583 . . . . 1.91 110.883 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 79.2 mt -61.47 -22.55 65.17 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.609 0.596 . . . . 1.71 112.609 -179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 4.3 pp -85.79 -9.37 57.17 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.646 -0.422 . . . . 2.2 111.187 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -123.21 56.45 1.18 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.605 0.717 . . . . 1.53 110.563 -179.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 27.0 p90 -64.01 -7.12 7.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.597 -0.729 . . . . 2.35 112.371 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -65.04 -34.26 78.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.027 0.441 . . . . 4.54 110.662 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -96.74 23.7 6.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.757 -0.656 . . . . 1.7 111.501 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -52.37 -54.51 41.21 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 112.601 0.593 . . . . 1.06 112.601 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.34 -29.11 46.4 Favored 'Trans proline' 0 C--N 1.355 0.89 0 C-N-CA 121.563 1.509 . . . . 0.62 112.34 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -72.71 -46.14 55.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.931 -0.577 . . . . 3.25 111.226 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 35.8 m -71.74 -26.19 25.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.781 -0.368 . . . . 1.12 110.6 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.94 -47.8 67.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.111 -0.495 . . . . 0.99 111.194 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -69.85 -36.23 75.37 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.825 -0.35 . . . . 1.4 110.448 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.2 mtm -63.89 -42.64 97.41 Favored 'General case' 0 CA--C 1.522 -0.129 0 N-CA-C 109.754 -0.462 . . . . 2.13 109.754 178.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 73.9 t90 -61.09 -47.09 87.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.575 -0.739 . . . . 0.47 109.463 178.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.456 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 37.3 ttpt -59.23 -51.46 69.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.362 -0.835 . . . . 1.71 110.606 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -58.78 -43.71 90.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.013 -0.539 . . . . 1.96 111.589 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -60.41 -47.32 86.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.313 -0.403 . . . . 2.37 111.37 -179.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 55.5 mtp -72.0 -11.76 60.92 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.77 0.285 . . . . 1.15 111.77 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 67.3 mt -95.17 -8.61 35.82 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.755 0.312 . . . . 1.39 110.65 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -79.89 130.02 68.5 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.331 -0.395 . . . . 3.14 110.472 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.15 -8.95 24.86 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.937 2.425 . . . . 1.07 112.436 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.43 -17.88 50.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.293 0.568 . . . . 1.64 110.133 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 76.9 t -89.3 111.06 22.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 CA-C-N 115.394 -0.821 . . . . 1.17 110.41 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -69.17 163.1 25.64 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.915 -0.584 . . . . 2.2 110.898 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.4 -34.98 59.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 1.52 111.878 -179.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 40.2 mmm-85 -58.45 -48.13 81.75 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.173 0.511 . . . . 4.09 110.49 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 36.7 mmt-85 -71.58 -35.73 70.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.789 -0.641 . . . . 3.61 110.761 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.3 mttt -61.72 -48.32 81.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.818 0.342 . . . . 1.15 110.372 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 24.2 tp -63.74 -37.03 85.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.149 -0.478 . . . . 1.87 110.409 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -64.44 -45.18 88.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.983 -0.553 . . . . 2.11 110.568 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.5 -31.01 77.48 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.912 -0.661 . . . . 0.4 112.015 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 43.4 tp -64.47 -36.95 85.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.959 0.409 . . . . 1.88 110.51 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -63.4 -40.17 96.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.016 -0.538 . . . . 2.18 110.85 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 27.0 tp -62.99 -36.51 83.79 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.182 -0.463 . . . . 2.19 111.029 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.43 ' O ' HG21 ' A' ' 68' ' ' VAL . 14.3 tmm? -65.84 -46.6 77.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.271 -0.422 . . . . 1.17 110.296 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -59.34 -39.1 82.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.075 -0.512 . . . . 2.22 110.772 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -63.44 -56.83 13.07 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.625 -0.716 . . . . 2.15 111.849 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 27.8 m -62.71 -38.98 83.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 113.28 0.844 . . . . 2.07 113.28 -177.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.43 HG21 ' O ' ' A' ' 64' ' ' MET . 32.6 m -73.91 -28.43 24.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 120.447 -0.501 . . . . 1.18 111.718 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -78.51 -45.56 21.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.776 0.322 . . . . 2.59 110.468 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -71.58 -17.94 62.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.311 -0.404 . . . . 2.55 110.875 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.49 -22.98 67.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.204 -0.453 . . . . 1.16 111.097 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.4 mmtt -63.19 -36.59 84.14 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.279 -0.418 . . . . 2.55 110.589 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -80.23 -28.81 47.74 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.741 -0.743 . . . . 0.66 111.886 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -80.1 -22.26 42.37 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.795 0.331 . . . . 1.91 110.279 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm 65.73 29.3 10.76 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.449 -0.796 . . . . 3.18 111.111 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 33.1 mm -104.15 92.87 2.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.514 -0.767 . . . . 1.2 109.508 179.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 17.3 pt -70.3 -14.57 18.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.935 -0.575 . . . . 1.4 111.304 -179.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 17.6 mp0 -55.69 -39.06 70.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.37 -0.377 . . . . 2.37 110.81 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -69.23 -50.68 45.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.117 -0.492 . . . . 2.23 110.766 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -63.89 -34.61 78.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.729 -0.669 . . . . 1.45 111.44 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.476 ' O ' ' HG2' ' A' ' 85' ' ' LYS . 6.7 t70 -67.54 -50.79 56.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.973 0.416 . . . . 1.32 110.456 179.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.7 m -66.05 -44.64 83.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.795 -0.639 . . . . 1.18 111.981 -179.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -75.49 -27.18 58.7 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 121.04 -0.264 . . . . 2.13 111.534 -179.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.71 -44.51 89.34 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.807 -0.711 . . . . 0.34 113.261 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.476 ' HG2' ' O ' ' A' ' 81' ' ' ASP . 2.3 ptpp? -65.96 -27.4 68.12 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.05 0.389 . . . . 1.9 112.05 -179.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 35.3 m -93.8 -21.8 5.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 120.742 -0.383 . . . . 1.04 111.075 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.446 ' O ' ' HB2' ' A' ' 91' ' ' LEU . . . -62.84 -43.07 99.77 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.275 -0.42 . . . . 1.09 110.98 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.58 -35.42 70.37 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.117 0.484 . . . . 1.13 110.998 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.644 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 6.1 tp10 -76.28 -56.29 4.78 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.97 -0.559 . . . . 1.56 110.279 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 70.5 t -56.91 -46.75 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.236 -0.438 . . . . 1.15 112.052 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.446 ' HB2' ' O ' ' A' ' 87' ' ' ALA . 2.4 mm? -60.23 -39.76 87.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.685 0.278 . . . . 2.15 110.587 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -67.93 -27.88 73.56 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.666 -0.778 . . . . 0.41 112.248 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.644 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 11.8 mmt85 -80.48 -50.9 9.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.666 0.27 . . . . 3.95 111.014 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.407 ' HA ' ' CG ' ' A' ' 97' ' ' GLU . 41.8 pt -64.56 -31.88 55.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 111.808 0.299 . . . . 1.22 111.808 -178.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -68.8 -17.37 64.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.701 0.286 . . . . 1.06 111.385 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 11.5 pt20 -106.93 8.12 30.37 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 122.014 -0.429 . . . . 1.57 111.776 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 6.2 pt-20 -129.79 -30.5 2.04 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.711 0.291 . . . . 1.33 111.096 178.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -71.47 139.52 84.08 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.382 -0.372 . . . . 2.29 111.055 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.427 ' HD2' HD12 ' A' ' 102' ' ' LEU . 37.0 Cg_endo -66.9 177.09 3.79 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.92 2.413 . . . . 1.47 112.337 178.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . 0.506 ' O ' ' HG2' ' A' ' 103' ' ' LYS . 17.1 mmm-85 -57.33 -44.3 84.13 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.476 0.547 . . . . 5.56 112.476 -178.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.23 -32.62 74.15 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.673 0.249 . . . . 2.58 111.673 -178.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.427 HD12 ' HD2' ' A' ' 99' ' ' PRO . 15.6 mt -83.46 -35.54 24.87 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.823 -0.351 . . . . 1.4 111.497 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' ' 100' ' ' ARG . 10.9 ptmm? -63.02 -33.17 74.86 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.915 0.388 . . . . 2.83 109.972 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 47.2 mttt -67.65 -39.6 84.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.058 -0.519 . . . . 2.98 110.645 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.455 ' O ' HG22 ' A' ' 109' ' ' VAL . 81.9 mttt -66.14 -42.77 88.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.786 -0.643 . . . . 2.89 110.679 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 103' ' ' LYS . 3.7 pp -72.51 -23.03 60.96 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.626 -0.429 . . . . 1.81 110.588 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 61.7 m -61.91 -45.08 95.26 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 116.53 -0.305 . . . . 1.53 110.537 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -73.52 -27.98 61.65 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.805 -0.358 . . . . 4.16 110.493 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.544 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 94.5 t -68.52 -47.22 78.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.335 -0.393 . . . . 1.81 110.209 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 9.3 p -75.69 -24.8 17.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 1.68 110.746 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -65.26 -48.4 73.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.283 -0.417 . . . . 2.24 110.479 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.433 HG23 ' O ' ' A' ' 109' ' ' VAL . 11.4 tt -63.61 -26.19 40.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.376 -0.375 . . . . 1.8 110.867 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 87.5 mt -67.59 -41.99 83.21 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.765 0.317 . . . . 1.98 111.003 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -84.49 -26.52 28.08 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.807 -0.357 . . . . 2.17 111.0 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -71.49 -35.36 70.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.833 0.349 . . . . 2.2 110.818 179.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 31.5 mmm180 -94.13 3.37 55.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.252 -0.431 . . . . 3.8 111.001 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 52.09 56.83 7.2 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.454 0.645 . . . . 2.23 110.433 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 44.5 mm -72.47 -46.45 55.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.457 -0.792 . . . . 1.26 111.116 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -105.55 170.46 7.88 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.265 -0.425 . . . . 2.11 110.994 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.16 147.09 53.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.958 -0.565 . . . . 1.55 110.302 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -57.24 -29.2 63.59 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.931 0.396 . . . . 3.34 111.343 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -59.56 -47.66 84.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.969 -0.559 . . . . 3.37 111.578 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.52 ' O ' HG13 ' A' ' 127' ' ' ILE . 10.8 p -84.86 -31.27 7.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.295 -0.411 . . . . 1.92 111.274 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 39.0 t -59.34 -43.1 89.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 120.913 0.387 . . . . 1.92 110.381 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -67.69 -20.25 65.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.804 -0.635 . . . . 2.18 111.045 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -83.35 -36.12 24.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.985 0.421 . . . . 1.44 110.266 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 123' ' ' VAL . 42.2 mt -68.04 -51.32 50.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.156 -0.474 . . . . 1.17 110.875 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.58 -38.41 84.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.37 -0.377 . . . . 2.05 111.84 -179.031 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 15.3 ptp180 -71.21 -33.85 70.3 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.738 -0.385 . . . . 4.63 110.65 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 67.8 m -65.16 -38.59 91.06 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.03 0.443 . . . . 0.93 110.225 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 127' ' ' ILE . 58.2 mt -65.74 -40.2 91.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.846 -0.616 . . . . 2.04 109.947 179.369 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.7 -33.85 66.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.784 -0.643 . . . . 1.22 111.103 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.47 -37.54 86.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.928 0.394 . . . . 1.45 111.126 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 116.05 -0.523 . . . . 1.28 110.888 180.0 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 . . . . . 0 CA--C 1.529 0.157 0 CA-C-O 121.036 0.446 . . . . 3.17 111.108 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -87.22 -40.36 14.62 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.102 -0.499 . . . . 1.44 110.059 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.39 -38.85 92.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.738 -0.665 . . . . 1.38 111.623 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.83 -29.78 69.79 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.327 -0.397 . . . . 1.95 110.83 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.474 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 62.4 mmtt -71.8 -42.91 66.5 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 120.973 0.416 . . . . 1.78 110.625 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.92 -23.53 67.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.832 -0.622 . . . . 2.19 111.395 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -95.21 5.04 52.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.163 -0.471 . . . . 1.96 112.028 -178.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 p -130.61 20.47 5.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 2.11 111.253 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 52.0 mt -102.87 133.17 48.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.865 0.364 . . . . 1.63 111.577 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -100.32 173.69 6.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.601 -0.727 . . . . 2.16 109.359 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -80.83 35.57 0.37 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.408 0.623 . . . . 1.94 110.896 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.466 ' HB3' ' OG ' ' A' ' 21' ' ' SER . 4.0 t -107.26 136.95 46.2 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.102 -0.499 . . . . 1.89 109.735 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.444 ' H ' ' HG2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -57.87 -44.0 86.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.935 -0.575 . . . . 3.13 111.289 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -62.97 -39.47 94.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.688 0.28 . . . . 2.99 111.432 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.466 ' OG ' ' HB3' ' A' ' 18' ' ' SER . 4.7 m -62.43 -50.56 71.01 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.356 -0.384 . . . . 1.62 110.387 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.9 mm -63.42 -38.43 82.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.261 -0.427 . . . . 1.52 109.983 179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 47.0 t -60.31 -39.34 86.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.936 -0.574 . . . . 1.63 110.539 179.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.4 m -61.09 -45.42 94.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 1.4 110.752 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.12 -34.29 66.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.397 -0.365 . . . . 1.14 110.827 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 44.0 t -62.7 -50.75 69.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.972 -0.558 . . . . 1.62 110.373 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -59.12 -37.12 76.46 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.133 0.492 . . . . 2.76 110.495 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.447 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 9.3 t90 -66.39 -39.13 88.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.379 -0.828 . . . . 1.14 110.724 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.7 tp -76.05 -35.51 59.41 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.406 -0.361 . . . . 1.91 111.015 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 78.4 mt -60.18 -32.02 70.68 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.179 -0.464 . . . . 1.71 112.248 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 2.8 pp -78.62 -26.66 45.33 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.793 -0.363 . . . . 2.2 111.21 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -98.1 48.74 1.0 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.627 0.727 . . . . 1.53 110.669 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.6 p90 -70.9 -4.22 23.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.462 -0.79 . . . . 2.35 111.467 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -70.54 -30.09 66.73 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.168 -0.679 . . . . 4.54 109.168 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -107.94 31.87 5.18 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.202 -0.908 . . . . 1.7 110.091 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.453 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -51.57 -51.6 68.12 Favored Pre-proline 0 CA--C 1.537 0.452 0 CA-C-N 115.653 -0.703 . . . . 1.06 112.097 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.453 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 32.8 Cg_endo -64.42 -31.63 61.55 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 121.582 1.521 . . . . 0.62 111.822 179.212 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.5 -47.74 69.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.866 -0.606 . . . . 3.25 111.247 -179.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.2 m -71.97 -27.51 27.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 C-N-CA 120.705 -0.398 . . . . 1.12 110.322 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.13 -47.27 62.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.166 -0.47 . . . . 0.99 110.426 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -68.66 -35.91 77.87 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.226 -0.443 . . . . 1.4 109.992 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 14.7 ttm -64.26 -42.85 96.28 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.06 -0.518 . . . . 2.13 110.119 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 61.9 t90 -60.14 -52.08 66.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.446 -0.797 . . . . 0.47 110.674 179.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.0 ttpt -61.03 -50.22 74.23 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.633 -0.712 . . . . 1.71 111.629 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -61.46 -33.66 74.12 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.307 -0.406 . . . . 1.96 112.045 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -73.9 -44.51 55.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.628 0.251 . . . . 2.37 111.004 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 62.6 mtp -70.48 -13.46 62.13 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.002 0.371 . . . . 1.15 112.002 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 49.9 mt -92.93 2.15 56.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.943 0.401 . . . . 1.39 110.609 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 59.2 mtp180 -88.0 136.5 32.21 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.105 -0.498 . . . . 3.14 110.443 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -68.98 -12.61 34.78 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.793 2.328 . . . . 1.07 112.337 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.44 -6.35 56.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.791 -0.641 . . . . 1.64 111.191 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 42.3 t -100.38 118.53 47.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.94 0.4 . . . . 1.17 110.798 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -74.68 158.45 33.57 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.799 -0.637 . . . . 2.2 110.223 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -33.23 62.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.403 -0.362 . . . . 1.52 111.781 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.0 mmm-85 -59.48 -44.74 92.98 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.142 -0.481 . . . . 4.09 110.939 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 12.4 mmt180 -75.84 -30.35 58.92 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.436 -0.347 . . . . 3.61 110.88 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -64.16 -41.98 96.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.03 0.443 . . . . 1.15 109.888 179.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 25.6 tp -66.41 -40.57 89.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.832 -0.622 . . . . 1.87 110.216 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -64.53 -41.83 96.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.051 -0.522 . . . . 2.11 110.388 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.19 -36.68 93.17 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.791 -0.719 . . . . 0.4 111.619 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 30.6 tp -63.8 -35.9 82.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.937 0.399 . . . . 1.88 110.122 178.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -65.09 -41.21 95.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.862 -0.608 . . . . 2.18 110.773 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 23.9 tp -64.94 -42.47 94.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.262 -0.426 . . . . 2.19 110.495 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 14.1 tmm? -61.52 -45.64 93.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.033 -0.53 . . . . 1.17 110.154 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -61.36 -36.32 79.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.83 -0.623 . . . . 2.22 111.089 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.556 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 4.3 t-80 -67.05 -56.88 8.16 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.744 -0.662 . . . . 2.15 111.456 -179.442 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 35.0 m -59.74 -39.29 79.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.218 0.821 . . . . 2.07 113.218 -177.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 34.7 m -71.12 -27.31 29.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 120.466 -0.494 . . . . 1.18 112.049 -178.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 62.7 mt-30 -73.68 -46.44 46.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.942 0.401 . . . . 2.59 110.131 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.556 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 37.5 mm-40 -74.58 -21.33 59.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.863 -0.608 . . . . 2.55 110.934 -179.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.58 -35.01 71.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.304 -0.407 . . . . 1.16 111.1 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -74.68 -20.81 59.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.86 0.362 . . . . 2.55 110.634 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -73.77 -32.54 59.05 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.698 -0.763 . . . . 0.66 111.241 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -97.69 -0.76 44.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.186 0.517 . . . . 1.91 109.87 179.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.8 mmmm 63.19 40.68 8.63 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.12 -0.945 . . . . 3.18 111.252 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.3 mm -100.25 86.28 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.091 -0.504 . . . . 1.2 109.783 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 25.2 pt -68.78 -18.6 23.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.847 -0.615 . . . . 1.4 111.489 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -59.47 -41.49 89.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.09 -0.505 . . . . 2.37 110.834 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -66.68 -50.68 62.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.852 -0.613 . . . . 2.23 111.188 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -62.06 -34.47 76.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.674 -0.694 . . . . 1.45 111.885 -178.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.485 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 13.8 t70 -71.26 -53.68 13.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.706 0.288 . . . . 1.32 110.359 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.9 m -59.28 -44.09 92.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.882 -0.599 . . . . 1.18 112.04 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -77.29 -35.82 54.76 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.771 0.285 . . . . 2.13 111.771 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.85 -41.21 97.59 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 121.178 -0.534 . . . . 0.34 114.039 -178.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.485 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 12.7 ptpt -65.71 -31.12 71.94 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.324 0.49 . . . . 1.9 112.324 -178.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.3 m -95.83 -19.38 6.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.64 -0.424 . . . . 1.04 111.241 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.68 -42.14 99.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.394 -0.367 . . . . 1.09 111.242 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.29 -41.71 80.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.439 . . . . 1.13 110.985 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.615 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 6.3 tp10 -67.0 -54.04 25.57 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.902 -0.59 . . . . 1.56 110.493 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 96.0 t -59.3 -45.65 93.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 1.15 111.607 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -56.78 -44.16 81.58 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.538 -0.301 . . . . 2.15 111.293 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -66.97 -37.19 91.97 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.454 -0.879 . . . . 0.41 112.424 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.615 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 9.8 mmt180 -68.17 -48.4 65.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.696 0.284 . . . . 3.95 110.958 -179.652 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.488 ' HA ' ' HG2' ' A' ' 97' ' ' GLU . 45.2 pt -70.08 -23.88 25.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.079 0.466 . . . . 1.22 111.043 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -65.79 -24.67 66.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.975 -0.557 . . . . 1.06 110.832 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.43 ' HB3' ' HB2' ' A' ' 134' ' ' ALA . 9.6 pt20 -110.63 1.25 17.9 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.55 0.574 . . . . 1.57 112.55 -178.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.488 ' HG2' ' HA ' ' A' ' 94' ' ' ILE . 1.5 pt-20 -117.69 -20.05 9.08 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.864 -0.334 . . . . 1.33 111.665 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -80.87 145.77 58.18 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 120.799 0.333 . . . . 2.29 111.279 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -66.26 171.78 9.83 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 123.046 2.498 . . . . 1.47 112.164 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -56.99 -42.66 80.65 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.565 0.58 . . . . 5.56 112.565 -178.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.21 -46.79 76.02 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 121.133 -0.227 . . . . 2.58 111.299 -178.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 36.7 mt -71.81 -29.69 64.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.827 0.346 . . . . 1.4 110.67 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . 0.42 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 0.0 OUTLIER -56.02 -50.89 69.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.773 -0.648 . . . . 2.83 110.574 179.53 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 57.1 tttt -66.04 -36.07 82.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.265 -0.425 . . . . 2.98 110.659 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -63.58 -44.06 95.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.148 -0.478 . . . . 2.89 110.913 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.48 ' O ' HG12 ' A' ' 109' ' ' VAL . 1.7 pp -74.54 -27.86 60.7 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.974 -0.291 . . . . 1.81 110.693 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 52.4 m -67.47 -41.05 85.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.515 -0.312 . . . . 1.53 111.242 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . 0.461 ' O ' HG13 ' A' ' 112' ' ' ILE . 16.3 ptt180 -76.57 -31.75 57.74 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.848 -0.341 . . . . 4.16 110.708 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.48 HG12 ' O ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -69.02 -38.92 79.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-O 120.69 0.281 . . . . 1.81 110.637 -179.86 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 8.4 p -80.1 -21.13 11.83 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-O 121.257 0.551 . . . . 1.68 110.066 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -68.05 -41.6 81.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.743 -0.662 . . . . 2.24 109.625 179.397 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 108' ' ' ARG . 67.1 mt -62.64 -36.23 74.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.851 -0.613 . . . . 1.8 110.047 179.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 87.7 mt -61.84 -49.34 76.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 1.98 111.245 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -75.63 -28.04 58.65 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 121.008 -0.277 . . . . 2.17 111.59 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.438 ' HA ' ' OE1' ' A' ' 115' ' ' GLU . 2.6 mm-40 -73.71 -39.2 64.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.711 0.291 . . . . 2.2 111.064 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -83.79 -0.6 51.71 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.803 0.335 . . . . 3.8 110.367 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.89 48.42 8.92 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.435 -0.802 . . . . 2.23 110.808 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 42.9 mm -70.42 -46.14 72.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.75 -0.659 . . . . 1.26 109.979 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -101.84 164.71 11.58 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.811 -0.631 . . . . 2.11 110.19 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.6 t -68.77 145.82 53.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.211 -0.449 . . . . 1.55 110.162 179.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -59.03 -25.94 64.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.487 -0.324 . . . . 3.34 110.778 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -62.39 -38.56 90.08 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.074 -0.512 . . . . 3.37 111.09 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.465 ' O ' HG13 ' A' ' 127' ' ' ILE . 12.9 p -90.27 -31.48 5.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.841 -0.344 . . . . 1.92 110.504 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.7 t -59.8 -38.33 75.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 120.984 0.421 . . . . 1.92 110.245 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -62.25 -26.53 68.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.809 -0.632 . . . . 2.18 110.77 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.511 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 38.7 t70 -87.28 -36.67 17.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.351 -0.386 . . . . 1.44 110.205 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . 0.516 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 77.2 mt -60.89 -50.51 80.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.226 -0.443 . . . . 1.17 110.723 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -63.73 -37.29 86.79 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.396 -0.365 . . . . 2.05 111.578 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.511 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 6.5 ptp180 -70.34 -32.47 70.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.621 -0.263 . . . . 4.63 110.852 -179.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 49.0 m -65.89 -40.2 91.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.885 0.374 . . . . 0.93 110.394 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 127' ' ' ILE . 23.8 mt -66.26 -44.41 83.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.988 -0.551 . . . . 2.04 110.245 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.91 -36.63 78.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.886 -0.597 . . . . 1.22 111.715 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -59.25 -46.18 89.19 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.963 0.357 . . . . 1.45 111.963 -179.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . 0.43 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . . . . . . . . 0 C--N 1.324 -0.524 0 CA-C-O 120.855 0.359 . . . . 1.28 111.468 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 . . . . . 0 C--O 1.23 0.048 0 CA-C-O 120.834 0.349 . . . . 3.17 110.617 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -64.13 -47.38 80.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.945 -0.57 . . . . 1.44 110.285 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -39.14 93.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.06 -0.518 . . . . 1.38 110.881 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 12.2 m -63.36 -35.89 81.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.964 -0.562 . . . . 1.95 110.59 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.491 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 65.4 mmtt -65.04 -41.86 94.82 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.046 -0.524 . . . . 1.78 110.247 179.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -62.0 -34.49 76.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.853 -0.612 . . . . 2.19 111.235 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -77.98 -5.67 52.0 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.992 -0.549 . . . . 1.96 111.695 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 p -123.83 18.56 9.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.815 0.34 . . . . 2.11 111.604 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 17.0 mt -95.16 169.11 10.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.087 0.47 . . . . 1.63 111.39 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -139.79 -174.27 3.86 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.72 -0.673 . . . . 2.16 109.215 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -91.5 12.1 21.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.779 0.323 . . . . 1.94 111.424 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.461 ' O ' HG12 ' A' ' 22' ' ' ILE . 0.1 OUTLIER -85.41 132.25 34.25 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.867 -0.419 . . . . 1.89 109.867 179.093 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -29.37 70.29 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.69 0.281 . . . . 3.13 110.749 -179.455 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 -67.55 -44.09 79.1 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.811 -0.44 . . . . 2.99 109.811 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.1 m -64.63 -41.24 96.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.929 -0.578 . . . . 1.62 109.922 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 18' ' ' SER . 38.3 mm -63.41 -49.0 84.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 N-CA-C 109.257 -0.645 . . . . 1.52 109.257 178.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.8 m -57.28 -35.8 70.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.127 -0.488 . . . . 1.63 111.001 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.5 t -59.82 -40.07 87.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.456 . . . . 1.4 111.077 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.5 -43.65 13.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.319 -0.401 . . . . 1.14 111.206 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.9 m -59.36 -41.31 88.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.255 -0.43 . . . . 1.62 111.624 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.518 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 21.2 ttpt -61.95 -35.25 77.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.755 0.312 . . . . 2.76 110.194 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.514 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 25.0 t90 -72.81 -40.61 65.7 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.47 -0.567 . . . . 1.14 109.47 179.265 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -62.95 -38.46 91.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.831 -0.622 . . . . 1.91 110.756 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 86.4 mt -63.75 -28.26 69.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.985 0.421 . . . . 1.71 110.537 179.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 68.9 mt -76.09 -27.63 57.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.945 -0.571 . . . . 2.2 109.546 178.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.514 ' HG2' ' O ' ' A' ' 28' ' ' TRP . 50.1 mm-40 -97.24 36.86 1.39 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.479 -0.782 . . . . 1.53 110.211 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.8 p90 -67.26 -1.58 4.74 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 121.057 0.456 . . . . 2.35 111.304 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -82.83 -8.8 59.55 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.02 -0.536 . . . . 4.54 109.86 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -131.39 37.75 3.67 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.687 -0.688 . . . . 1.7 110.343 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.427 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -57.36 -52.23 75.78 Favored Pre-proline 0 CA--C 1.537 0.481 0 CA-C-N 115.869 -0.605 . . . . 1.06 112.45 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.432 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 32.4 Cg_endo -64.74 -27.02 60.19 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 121.797 1.665 . . . . 0.62 112.362 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.6 -39.08 77.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.983 -0.553 . . . . 3.25 111.091 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 24.6 m -85.59 -22.58 7.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 120.61 -0.436 . . . . 1.12 110.669 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.36 -46.08 74.42 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.199 -0.455 . . . . 0.99 110.737 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 3.3 pt-20 -64.13 -40.75 96.84 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.257 -0.429 . . . . 1.4 110.052 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.421 ' N ' ' HG3' ' A' ' 41' ' ' GLU . 42.5 ttm -64.67 -41.07 96.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.596 -0.729 . . . . 2.13 110.521 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -62.18 -49.48 75.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.743 -0.662 . . . . 0.47 110.36 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.447 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 23.2 ttpp -57.82 -51.28 70.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.921 -0.581 . . . . 1.71 111.04 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 11.4 mm-40 -61.28 -38.65 87.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.144 -0.48 . . . . 1.96 111.168 -179.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.418 ' O ' HG21 ' A' ' 52' ' ' VAL . 79.1 t80 -62.03 -46.65 88.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.921 0.391 . . . . 2.37 110.67 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 76.9 mmm -67.05 -25.2 66.14 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.2 -0.454 . . . . 1.15 111.407 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 82.0 mt -93.94 12.7 25.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.396 -0.365 . . . . 1.39 111.299 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 11.9 mtp85 -96.66 133.56 24.39 Favored Pre-proline 0 C--N 1.327 -0.401 0 N-CA-C 110.333 -0.247 . . . . 3.14 110.333 179.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -70.28 -15.89 35.26 Favored 'Trans proline' 0 CA--C 1.53 0.284 0 C-N-CA 122.924 2.416 . . . . 1.07 113.307 -179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.69 10.47 7.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.032 0.444 . . . . 1.64 110.946 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.418 HG21 ' O ' ' A' ' 46' ' ' TYR . 41.2 t -110.39 122.0 64.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.949 -0.569 . . . . 1.17 110.514 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -69.01 156.45 38.6 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.96 -0.564 . . . . 2.2 110.93 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.12 -41.81 72.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.876 0.369 . . . . 1.52 111.73 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -68.89 -29.81 68.17 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.423 -0.353 . . . . 4.09 110.497 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.0 mmm-85 -70.96 -38.68 72.82 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.602 -0.518 . . . . 3.61 109.602 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.407 ' HZ1' ' CD ' ' A' ' 97' ' ' GLU . 74.9 mttt -67.21 -34.82 78.3 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.377 -0.601 . . . . 1.15 109.377 178.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 20.1 tp -63.05 -37.97 89.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.581 -0.736 . . . . 1.87 109.927 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 mp -66.25 -40.59 90.3 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.688 -0.687 . . . . 2.11 110.007 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.66 -33.79 88.18 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.916 -0.659 . . . . 0.4 111.562 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.84 -44.13 86.41 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.391 -0.596 . . . . 1.88 109.391 178.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -61.78 -39.47 91.81 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.284 -0.871 . . . . 2.18 110.876 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 20.2 tp -63.6 -41.28 98.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.928 -0.578 . . . . 2.19 110.389 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.471 ' O ' HG23 ' A' ' 68' ' ' VAL . 16.9 tmm? -62.87 -51.57 66.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.886 -0.597 . . . . 1.17 110.699 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -56.11 -35.52 67.15 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.063 0.458 . . . . 2.22 110.923 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -68.67 -58.12 4.7 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.709 -0.678 . . . . 2.15 111.687 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 17.5 m -60.52 -39.86 82.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 113.052 0.76 . . . . 2.07 113.052 -177.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 64' ' ' MET . 30.7 m -72.96 -31.03 34.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 120.515 -0.474 . . . . 1.18 111.88 -178.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -77.7 -43.09 32.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.954 0.407 . . . . 2.59 110.473 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -71.52 -24.89 62.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.197 -0.456 . . . . 2.55 110.588 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.29 -18.72 65.52 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.297 -0.41 . . . . 1.16 110.566 179.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt -68.29 -29.21 67.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.27 -0.423 . . . . 2.55 109.879 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.2 -47.73 28.68 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.965 -0.636 . . . . 0.66 111.574 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -78.75 -7.68 58.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.919 0.39 . . . . 1.91 110.289 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.7 mttp 60.46 40.27 17.37 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.489 -0.778 . . . . 3.18 111.267 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 40.1 mm -93.25 94.79 4.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.766 -0.652 . . . . 1.2 109.813 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 10.9 pt -70.73 -22.47 23.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.083 -0.508 . . . . 1.4 111.224 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -56.23 -33.46 65.41 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.916 0.389 . . . . 2.37 110.702 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -71.51 -53.44 13.85 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.934 -0.576 . . . . 2.23 110.577 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -63.88 -31.54 72.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.82 -0.627 . . . . 1.45 111.799 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -71.23 -57.36 4.56 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.964 0.412 . . . . 1.32 111.426 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.9 m -65.36 -42.35 92.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.878 -0.601 . . . . 1.18 112.327 -178.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -78.32 -28.66 47.38 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.7 -0.4 . . . . 2.13 111.184 -179.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -68.23 -42.9 82.09 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.777 -0.725 . . . . 0.34 113.051 -179.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -65.3 -27.12 68.39 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.019 0.377 . . . . 1.9 112.019 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.6 m -97.26 -18.29 6.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-O 120.772 0.32 . . . . 1.04 111.316 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.23 -45.53 91.2 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.254 -0.43 . . . . 1.09 111.382 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -50.88 -46.69 60.56 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.386 0.429 . . . . 1.13 111.515 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 3.5 tp10 -62.43 -60.03 4.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.76 -0.654 . . . . 1.56 110.529 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.456 ' O ' HG12 ' A' ' 94' ' ' ILE . 80.0 t -54.97 -49.4 71.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.837 -0.619 . . . . 1.15 112.363 -178.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 82.0 mt -61.09 -38.0 84.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.611 0.243 . . . . 2.15 111.629 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -72.22 -31.06 64.2 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.544 -0.836 . . . . 0.41 112.0 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.578 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 47.8 mmm-85 -76.59 -50.35 14.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.514 0.197 . . . . 3.95 111.233 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 90' ' ' VAL . 22.2 pt -65.18 -20.82 28.24 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.282 0 CA-C-O 120.609 0.242 . . . . 1.22 111.167 -179.297 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -62.86 -26.8 68.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.687 0.755 . . . . 1.06 109.677 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -101.59 2.94 39.48 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.469 -0.787 . . . . 1.57 110.785 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.407 ' CD ' ' HZ1' ' A' ' 57' ' ' LYS . 2.7 mt-10 -116.65 -15.87 10.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.134 -0.485 . . . . 1.33 111.281 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -95.1 125.63 49.77 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.22 -0.446 . . . . 2.29 111.193 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -61.79 174.5 2.28 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.719 2.279 . . . . 1.47 112.042 178.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . 0.42 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 14.6 ptt-85 -49.95 -33.46 17.71 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.835 0.68 . . . . 5.56 112.835 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -75.07 -52.77 10.22 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.928 -0.309 . . . . 2.58 111.683 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 35.5 mt -66.75 -35.63 80.56 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.225 0.454 . . . . 1.4 112.225 -178.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -65.83 -30.18 70.76 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.857 -0.337 . . . . 2.83 110.821 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.42 ' HG3' ' O ' ' A' ' 100' ' ' ARG . 43.1 mtmt -68.63 -23.87 64.48 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.329 0.585 . . . . 2.98 109.748 178.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 52.9 mttp -84.14 -28.95 27.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.446 -0.797 . . . . 2.89 108.977 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 26.1 tp -64.51 -45.33 87.74 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.498 -0.774 . . . . 1.81 109.823 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 1.4 p -63.87 -25.87 68.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 1.53 110.674 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 39.3 mtt-85 -72.61 -24.35 61.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.949 -0.569 . . . . 4.16 110.982 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.488 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 49.0 t -91.48 -48.77 13.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 116.081 -0.509 . . . . 1.81 110.105 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 71.8 t -56.66 -44.36 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.67 -0.695 . . . . 1.68 112.187 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.93 -38.46 91.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.616 0.246 . . . . 2.24 111.256 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 57.9 mt -71.02 -40.05 75.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.801 0.334 . . . . 1.8 110.777 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 89.5 mt -58.72 -39.52 81.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 1.98 111.913 -179.237 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 11.7 ptpt -83.08 -40.86 19.3 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.976 -0.289 . . . . 2.17 111.759 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -66.71 -33.83 76.49 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.034 0.383 . . . . 2.2 112.034 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.7 mmm180 -85.73 0.04 53.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.751 -0.204 . . . . 3.8 110.993 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 56.14 52.03 10.95 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.33 0.586 . . . . 2.23 110.116 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 49.7 mm -77.35 -49.12 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.837 -0.62 . . . . 1.26 110.481 -179.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -102.25 171.98 7.16 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.087 -0.506 . . . . 2.11 110.327 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.22 158.83 35.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.998 -0.547 . . . . 1.55 110.341 179.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 125' ' ' ASN . 2.0 mmmt -57.41 -39.82 76.99 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.515 -0.311 . . . . 3.34 111.584 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -66.66 -27.77 67.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.749 0.309 . . . . 3.37 111.141 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 90.0 t -80.73 -51.22 16.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.47 -0.332 . . . . 1.92 111.243 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.506 ' O ' ' HG2' ' A' ' 128' ' ' GLU . 26.9 m -61.74 -30.2 47.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.772 0.32 . . . . 1.92 111.131 -179.451 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . 0.413 ' HB2' ' O ' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -72.29 -27.32 62.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.208 -0.451 . . . . 2.18 110.654 179.589 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -79.16 -36.27 40.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.187 -0.46 . . . . 1.44 110.023 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 81.3 mt -63.4 -54.61 30.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.873 -0.603 . . . . 1.17 111.049 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.506 ' HG2' ' O ' ' A' ' 124' ' ' VAL . 5.2 pt-20 -61.59 -38.68 88.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.351 -0.386 . . . . 2.05 111.794 -178.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -68.15 -29.25 68.1 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.751 -0.38 . . . . 4.63 110.724 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 65.0 m -72.17 -40.36 68.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.839 0.352 . . . . 0.93 110.161 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.1 mp -64.12 -39.42 93.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.191 0.519 . . . . 2.04 109.922 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.05 -42.28 63.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.502 -0.772 . . . . 1.22 111.213 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.44 -25.58 67.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 1.45 111.274 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.424 0 CA-C-N 116.096 -0.502 . . . . 1.28 110.75 179.406 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.46 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 18.5 mt-30 . . . . . 0 C--O 1.226 -0.152 0 N-CA-C 111.521 0.193 . . . . 3.17 111.521 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.613 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 82.4 t80 -77.12 -43.94 32.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.039 0.447 . . . . 1.44 110.785 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.0 -41.22 96.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.907 -0.588 . . . . 1.38 112.358 -179.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.9 t -69.39 -24.39 63.86 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.709 -0.223 . . . . 1.95 111.408 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 71.2 mmtt -68.11 -37.62 81.35 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.973 0.416 . . . . 1.78 110.052 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -62.22 -32.59 73.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.602 -0.726 . . . . 2.19 111.153 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 54.8 m-20 -77.57 -11.32 59.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.108 -0.496 . . . . 1.96 111.287 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.99 9.66 18.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.843 0.354 . . . . 2.11 111.465 -179.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 17.9 mt -85.94 165.0 17.1 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.129 0.49 . . . . 1.63 111.372 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -144.18 169.58 17.61 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.581 -0.736 . . . . 2.16 109.458 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -84.38 41.9 0.86 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.425 0.631 . . . . 1.94 111.453 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -119.33 139.23 52.3 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.991 -0.55 . . . . 1.89 109.708 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.2 pm0 -61.39 -39.58 91.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.679 -0.237 . . . . 3.13 111.016 -179.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.77 -42.22 99.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.123 0.487 . . . . 2.99 110.258 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.8 m -65.28 -46.98 78.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.025 -0.534 . . . . 1.62 111.012 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 38.4 mm -65.39 -44.98 94.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 CA-C-N 116.354 -0.384 . . . . 1.52 110.235 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.9 t -56.18 -43.38 78.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.876 -0.602 . . . . 1.63 111.082 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.0 m -59.21 -36.85 76.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.247 -0.433 . . . . 1.4 111.868 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -83.01 -40.52 19.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.767 0.318 . . . . 1.14 111.111 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.6 m -62.29 -43.64 98.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.301 -0.409 . . . . 1.62 111.038 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.613 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 0.3 OUTLIER -64.06 -38.74 92.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.318 -0.401 . . . . 2.76 110.095 179.67 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 37.5 t90 -64.89 -38.57 91.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.025 -0.534 . . . . 1.14 110.287 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -67.09 -45.31 77.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.98 -0.555 . . . . 1.91 111.142 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 74.1 mt -64.26 -21.37 66.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.961 -0.563 . . . . 1.71 112.052 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 66.0 mt -70.64 -24.45 62.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.752 0.311 . . . . 2.2 110.991 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.417 ' C ' ' H ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -129.15 72.08 1.45 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.087 0.47 . . . . 1.53 110.991 -179.573 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.5 p90 -75.17 9.18 2.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.94 -0.573 . . . . 2.35 110.729 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.417 ' H ' ' C ' ' A' ' 32' ' ' GLN . 33.1 mtp-105 -71.0 -25.1 62.54 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.782 -0.644 . . . . 4.54 110.499 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -117.13 33.3 5.69 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.128 -0.487 . . . . 1.7 110.645 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.422 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -54.62 -51.65 76.71 Favored Pre-proline 0 CA--C 1.538 0.485 0 CA-C-N 115.512 -0.767 . . . . 1.06 112.282 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.422 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 35.5 Cg_endo -66.03 -29.49 48.62 Favored 'Trans proline' 0 C--N 1.356 0.936 0 C-N-CA 121.602 1.535 . . . . 0.62 112.182 179.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.6 tptm -70.58 -45.96 64.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.46 -0.336 . . . . 3.25 110.867 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 35.5 m -72.64 -25.79 23.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 120.837 -0.345 . . . . 1.12 110.49 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.37 -50.12 49.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 0.99 110.655 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -66.67 -35.32 79.86 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 110.207 -0.294 . . . . 1.4 110.207 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.613 ' SD ' ' HB3' ' A' ' 8' ' ' PHE . 57.0 ttm -66.48 -40.82 89.52 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.02 0.438 . . . . 2.13 109.839 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -60.29 -49.13 78.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.508 -0.769 . . . . 0.47 109.503 178.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -57.39 -46.68 83.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.092 -0.958 . . . . 1.71 110.837 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -62.97 -43.89 97.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.801 -0.636 . . . . 1.96 111.413 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.428 ' O ' HG21 ' A' ' 52' ' ' VAL . 81.2 t80 -64.67 -45.14 87.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.884 0.373 . . . . 2.37 111.227 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 56.4 mmm -67.4 -22.53 65.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.138 -0.483 . . . . 1.15 112.051 -178.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.7 mt -103.72 32.35 3.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.917 0.389 . . . . 1.39 111.579 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 59.3 mtp180 -113.76 144.02 30.64 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 116.364 -0.38 . . . . 3.14 110.567 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.35 -16.31 31.18 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.833 2.355 . . . . 1.07 112.613 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.05 4.8 21.58 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.014 -0.539 . . . . 1.64 111.255 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.428 HG21 ' O ' ' A' ' 46' ' ' TYR . 41.3 t -115.33 120.9 66.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.299 -0.41 . . . . 1.17 110.789 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -74.41 155.16 38.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.842 -0.617 . . . . 2.2 110.614 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.65 -36.96 62.67 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 122.876 0.47 . . . . 1.52 112.214 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -35.02 78.84 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.961 0.41 . . . . 4.09 110.451 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.4 mmm-85 -73.9 -37.21 64.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.079 -0.51 . . . . 3.61 110.544 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.437 ' HZ1' ' CD ' ' A' ' 97' ' ' GLU . 78.3 mttt -65.83 -32.25 73.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.049 -0.523 . . . . 1.15 109.755 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 32.0 tp -66.48 -40.64 89.41 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.072 -0.714 . . . . 1.87 109.072 178.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.6 mp -68.62 -39.81 80.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.503 -0.771 . . . . 2.11 110.187 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.34 -34.89 90.66 Favored Glycine 0 N--CA 1.452 -0.273 0 N-CA-C 111.58 -0.608 . . . . 0.4 111.58 179.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.2 tt -66.62 -39.97 88.58 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.335 -0.617 . . . . 1.88 109.335 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -61.32 -40.27 93.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.592 -0.731 . . . . 2.18 110.823 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.8 tp -62.16 -45.65 92.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.206 -0.452 . . . . 2.19 110.302 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.497 ' O ' HG23 ' A' ' 68' ' ' VAL . 16.0 tmm? -62.93 -47.17 84.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.854 -0.612 . . . . 1.17 109.838 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -56.45 -39.11 72.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.51 -0.768 . . . . 2.22 111.525 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -69.36 -53.0 21.72 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.004 -0.543 . . . . 2.15 111.447 -179.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 34.4 m -63.39 -32.6 57.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 112.731 0.641 . . . . 2.07 112.731 -178.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 64' ' ' MET . 34.5 m -80.07 -31.95 13.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.446 -0.502 . . . . 1.18 111.67 -179.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -75.48 -35.74 60.77 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.982 0.42 . . . . 2.59 110.594 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -84.09 -11.65 56.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.209 -0.45 . . . . 2.55 111.315 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.6 -23.46 66.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.445 -0.343 . . . . 1.16 111.087 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -66.77 -38.36 86.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.253 -0.431 . . . . 2.55 110.386 179.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -73.32 -30.52 62.5 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.923 -0.655 . . . . 0.66 111.658 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -81.13 -15.49 55.71 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.817 0.342 . . . . 1.91 110.329 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 62.9 mttp 65.1 26.67 12.51 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.446 -0.797 . . . . 3.18 110.679 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 36.7 mm -109.68 86.37 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.638 -0.71 . . . . 1.2 109.423 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.408 HG13 ' OE1' ' A' ' 78' ' ' GLN . 2.0 pp -73.11 -12.05 15.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.123 -0.489 . . . . 1.4 110.753 -179.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.408 ' OE1' HG13 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -59.74 -35.57 74.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.962 -0.563 . . . . 2.37 110.165 179.321 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.51 -43.7 89.25 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.299 0.571 . . . . 2.23 109.5 178.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -68.92 -36.97 78.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.194 -0.912 . . . . 1.45 111.191 -179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.402 ' O ' ' HG2' ' A' ' 85' ' ' LYS . 30.2 t70 -69.96 -43.95 70.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.901 0.382 . . . . 1.32 110.931 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' SER . . . . . 0.412 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 39.8 m -62.87 -44.44 96.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.052 -0.522 . . . . 1.18 111.193 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -79.22 -33.39 43.76 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-N 116.318 -0.401 . . . . 2.13 111.297 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.15 -44.27 94.9 Favored Glycine 0 N--CA 1.453 -0.226 0 N-CA-C 114.211 0.445 . . . . 0.34 114.211 -178.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.412 ' HE2' ' HA ' ' A' ' 82' ' ' SER . 0.0 OUTLIER -66.18 -20.88 66.27 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.204 0.446 . . . . 1.9 112.204 -178.772 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 20.4 m -106.41 -17.2 7.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.898 0.38 . . . . 1.04 110.902 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.76 -46.98 85.52 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.131 -0.486 . . . . 1.09 111.011 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.49 -40.43 71.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.254 -0.43 . . . . 1.13 110.735 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -66.27 -58.61 4.98 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.805 -0.634 . . . . 1.56 110.169 179.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.505 ' O ' HG12 ' A' ' 94' ' ' ILE . 81.7 t -56.02 -49.72 73.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.945 -0.571 . . . . 1.15 111.905 -178.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 94.8 mt -59.03 -43.45 91.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.817 -0.174 . . . . 2.15 111.424 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -65.82 -32.29 82.39 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.757 -0.735 . . . . 0.41 112.401 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 34.7 mmm-85 -77.55 -52.93 8.24 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.528 0.204 . . . . 3.95 111.245 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.505 HG12 ' O ' ' A' ' 90' ' ' VAL . 37.9 pt -66.97 -18.8 24.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.452 -0.34 . . . . 1.22 111.361 -179.048 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -61.64 -30.93 71.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.394 0.616 . . . . 1.06 109.812 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -85.74 -14.98 43.62 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.576 -0.738 . . . . 1.57 110.375 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.437 ' CD ' ' HZ1' ' A' ' 57' ' ' LYS . 53.9 mt-10 -92.11 -38.12 12.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.907 -0.588 . . . . 1.33 110.773 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 -67.28 122.03 81.16 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.566 -0.743 . . . . 2.29 111.383 -179.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -71.85 -175.88 1.84 Allowed 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.476 2.117 . . . . 1.47 112.337 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 15.9 ptt-85 -55.56 -27.37 48.76 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 113.119 0.785 . . . . 5.56 113.119 -178.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . 0.425 ' HA ' ' CE ' ' A' ' 104' ' ' LYS . 33.4 t70 -81.15 -46.09 15.42 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.654 -0.418 . . . . 2.58 111.845 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 22.5 mt -73.86 -29.2 61.97 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.363 0.505 . . . . 1.4 112.363 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 57.1 pttt -58.85 -28.42 66.06 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.792 0.329 . . . . 2.83 111.149 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.425 ' CE ' ' HA ' ' A' ' 101' ' ' ASP . 41.0 mtmt -64.42 -50.91 65.72 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.04 0.448 . . . . 2.98 110.599 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 40.9 mttp -68.47 -33.55 74.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.854 -0.612 . . . . 2.89 110.093 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 16.6 tp -63.39 -48.26 78.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.717 -0.674 . . . . 1.81 110.641 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.8 p -66.57 -33.57 75.96 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.941 -0.304 . . . . 1.53 110.796 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 39.0 mtt180 -64.08 -52.43 59.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.157 -0.474 . . . . 4.16 111.472 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.471 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 6.2 p -61.48 -42.17 92.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 121.085 -0.246 . . . . 1.81 110.961 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 50.5 t -60.4 -43.89 94.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 121.017 0.437 . . . . 1.68 110.175 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . 0.402 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 2.7 t-20 -60.11 -47.34 86.29 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.589 -0.732 . . . . 2.24 110.693 179.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 78.8 mt -63.59 -44.35 98.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.305 -0.407 . . . . 1.8 111.139 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 87.1 mt -60.28 -44.01 95.73 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.973 0.36 . . . . 1.98 111.973 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.402 ' HG3' ' O ' ' A' ' 111' ' ' ASN . 2.0 ptpt -75.1 -35.4 61.76 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.91 -0.316 . . . . 2.17 111.506 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -71.07 -27.07 63.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.634 0.255 . . . . 2.2 111.282 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 6.4 mtt-85 -90.76 -4.0 57.0 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.67 -0.493 . . . . 3.8 109.67 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 56.09 54.89 7.37 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.089 -0.959 . . . . 2.23 110.16 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 37.8 mm -73.86 -45.83 48.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.344 -0.844 . . . . 1.26 110.602 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -100.31 171.53 7.72 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.966 -0.561 . . . . 2.11 110.736 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.8 163.08 20.09 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.931 -0.577 . . . . 1.55 111.224 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.3 mmmp? -55.4 -43.38 75.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 3.34 111.683 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.92 -23.05 64.12 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.016 -0.538 . . . . 3.37 111.659 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 61.4 t -85.19 -49.18 15.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 121.144 -0.223 . . . . 1.92 111.26 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 27.8 m -61.17 -30.54 48.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.883 0.373 . . . . 1.92 111.181 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -80.84 -28.46 36.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 2.18 110.86 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.429 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 10.9 t70 -73.41 -40.55 64.18 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.017 0.437 . . . . 1.44 110.179 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 91.0 mt -60.62 -52.51 60.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.98 -0.555 . . . . 1.17 111.526 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -63.11 -33.98 76.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.227 0.454 . . . . 2.05 112.227 -178.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 13.1 ptt180 -74.81 -33.81 62.26 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.426 -0.51 . . . . 4.63 110.943 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 39.3 m -66.04 -44.62 84.1 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.983 0.42 . . . . 0.93 110.734 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.5 mp -62.04 -36.83 82.77 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.119 -0.491 . . . . 2.04 110.447 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.36 -41.15 66.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.785 -0.643 . . . . 1.22 110.851 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.05 -34.11 74.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.366 -0.379 . . . . 1.45 111.432 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.447 . . . . 1.28 111.177 179.803 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.419 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 97.0 mt-30 . . . . . 0 C--O 1.228 -0.05 0 CA-C-O 121.091 0.472 . . . . 3.17 109.737 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -72.6 -49.57 31.24 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.86 -0.609 . . . . 1.44 110.11 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -36.67 80.21 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.784 -0.644 . . . . 1.38 112.015 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.1 t -72.66 -26.95 61.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.455 -0.339 . . . . 1.95 110.674 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.419 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 22.6 mmmt -69.37 -27.78 65.62 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-O 120.701 0.286 . . . . 1.78 110.589 179.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.86 -29.87 71.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.956 -0.566 . . . . 2.19 110.577 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -81.48 -20.8 39.44 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.054 -0.521 . . . . 1.96 110.496 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.2 p -101.16 24.69 9.09 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.066 -0.515 . . . . 2.11 111.554 -179.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 15.8 mt -77.36 165.44 24.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.037 0.446 . . . . 1.63 111.373 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -144.88 168.25 20.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.82 -0.627 . . . . 2.16 109.377 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -82.62 -20.85 35.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.663 0.268 . . . . 1.94 111.316 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.446 ' HB2' ' OG ' ' A' ' 21' ' ' SER . 3.5 m -61.61 133.87 56.15 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 1.89 111.082 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.02 -34.89 79.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.85 -0.614 . . . . 3.13 110.554 -178.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -66.15 -38.66 88.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.821 -0.627 . . . . 2.99 110.745 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.446 ' OG ' ' HB2' ' A' ' 18' ' ' SER . 4.3 m -68.16 -38.9 82.61 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.147 -0.479 . . . . 1.62 110.163 179.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.9 mm -67.32 -34.97 72.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 N-CA-C 109.047 -0.723 . . . . 1.52 109.047 178.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.0 m -63.26 -33.78 76.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.185 -0.916 . . . . 1.63 111.179 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.1 m -62.43 -47.58 83.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 1.4 110.722 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.35 -40.66 81.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.101 -0.5 . . . . 1.14 110.632 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 29.1 t -61.32 -48.89 79.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.025 -0.534 . . . . 1.62 110.771 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -26.8 68.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 2.76 111.1 -179.583 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 13.9 t90 -78.15 -37.83 45.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.153 -0.476 . . . . 1.14 110.169 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -67.52 -35.4 79.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.669 -0.696 . . . . 1.91 110.911 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.7 -23.9 67.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.408 -0.36 . . . . 1.71 111.774 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 68.4 mt -81.09 -20.75 40.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.074 0.464 . . . . 2.2 111.065 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -110.27 41.45 1.74 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.11 0.481 . . . . 1.53 110.443 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 54.6 p90 -59.11 -20.6 54.95 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.802 -0.635 . . . . 2.35 112.098 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.3 ttp180 -71.47 -25.49 62.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.034 0.445 . . . . 4.54 110.711 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.33 16.97 25.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.897 -0.592 . . . . 1.7 110.739 -179.464 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.499 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.38 -50.88 77.27 Favored Pre-proline 0 CA--C 1.536 0.404 0 CA-C-N 115.735 -0.666 . . . . 1.06 112.51 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.499 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 18.1 Cg_endo -59.81 -31.69 94.32 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 121.83 1.687 . . . . 0.62 112.708 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.3 tptt -76.57 -41.22 47.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.318 -0.401 . . . . 3.25 111.345 -178.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.1 m -73.17 -29.77 29.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 C-N-CA 120.396 -0.522 . . . . 1.12 110.546 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.83 -46.41 71.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.185 -0.461 . . . . 0.99 111.34 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 7.4 pt-20 -64.84 -40.78 95.72 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 110.049 -0.352 . . . . 1.4 110.049 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 65.7 mtm -65.47 -37.31 86.47 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.961 0.41 . . . . 2.13 109.945 179.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 63.5 t90 -59.55 -48.27 82.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.493 -0.776 . . . . 0.47 109.742 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.9 ttpt -60.83 -45.07 95.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.209 -0.451 . . . . 1.71 110.676 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.533 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 10.0 mm-40 -60.53 -47.09 87.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.963 -0.562 . . . . 1.96 110.851 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -65.43 -44.18 88.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 2.37 111.115 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 70.3 mmm -66.16 -22.98 66.39 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.104 0.409 . . . . 1.15 112.104 -179.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.3 mt -99.68 7.47 45.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.602 0.239 . . . . 1.39 111.487 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.533 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 41.9 mtp180 -84.92 132.57 45.49 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.954 -0.387 . . . . 3.14 109.954 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -67.07 -11.69 33.23 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.754 2.303 . . . . 1.07 112.59 -179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -16.43 59.24 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.171 0.51 . . . . 1.64 110.6 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.2 t -92.18 123.87 44.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.799 -0.637 . . . . 1.17 110.769 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -69.61 153.31 43.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.795 -0.639 . . . . 2.2 110.601 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.35 -39.69 64.35 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.017 -0.538 . . . . 1.52 112.354 -179.477 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -68.82 -32.6 72.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.845 0.355 . . . . 4.09 110.954 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.7 mmt85 -71.45 -32.65 68.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.314 -0.403 . . . . 3.61 110.016 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.1 mttt -67.65 -34.29 76.66 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.452 -0.573 . . . . 1.15 109.452 178.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 40.8 tp -63.3 -43.64 97.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.773 -0.648 . . . . 1.87 109.797 178.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 94.1 mt -65.47 -40.76 93.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.812 -0.631 . . . . 2.11 110.034 179.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.9 -30.69 78.46 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.983 -0.627 . . . . 0.4 111.743 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 25.8 tp -71.78 -38.82 70.25 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.918 0.389 . . . . 1.88 110.138 178.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -65.96 -31.37 72.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.961 -0.563 . . . . 2.18 110.568 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 56.7 tp -65.73 -44.5 85.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.956 -0.565 . . . . 2.19 110.627 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.479 ' HG3' ' N ' ' A' ' 65' ' ' ASN . 0.0 OUTLIER -67.13 -34.61 77.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 1.17 110.841 -179.61 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.479 ' N ' ' HG3' ' A' ' 64' ' ' MET . 11.2 t30 -63.44 -37.29 86.73 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.343 0.592 . . . . 2.22 110.528 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -68.22 -52.87 29.3 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.382 -0.826 . . . . 2.15 111.295 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 7.1 p -63.43 -39.42 85.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 112.9 0.704 . . . . 2.07 112.9 -177.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 64' ' ' MET . 33.5 m -73.57 -24.58 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 C-N-CA 120.416 -0.514 . . . . 1.18 111.517 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -75.18 -47.66 27.3 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.111 -0.329 . . . . 2.59 110.111 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -72.08 -23.16 61.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.186 -0.461 . . . . 2.55 110.732 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.09 -29.09 70.07 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-N 116.392 -0.367 . . . . 1.16 111.125 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.452 ' HD2' ' HA ' ' A' ' 118' ' ' ILE . 42.8 mtpt -68.01 -34.88 77.34 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.441 -0.345 . . . . 2.55 110.371 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.46 -30.4 75.08 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.924 -0.655 . . . . 0.66 111.753 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -95.62 -2.09 48.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.731 0.3 . . . . 1.91 110.447 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm 62.01 23.75 14.04 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.686 -0.688 . . . . 3.18 112.121 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 23.3 mm -86.36 78.91 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.861 -0.422 . . . . 1.2 109.861 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 10.3 pt -64.42 -11.71 10.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.861 -0.609 . . . . 1.4 111.71 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.96 -26.75 68.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.095 -0.502 . . . . 2.37 110.492 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -73.5 -51.23 17.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 2.23 110.865 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -63.96 -28.65 69.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 1.45 111.311 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -73.24 -50.28 23.22 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.208 0.527 . . . . 1.32 109.968 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.4 m -64.4 -47.1 80.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.455 -0.793 . . . . 1.18 111.65 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -76.77 -30.22 56.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.605 0.24 . . . . 2.13 111.308 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.7 -42.21 93.38 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.078 -0.582 . . . . 0.34 113.479 -179.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 9.7 ptpt -60.55 -27.06 67.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.752 0.276 . . . . 1.9 111.539 -179.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.1 m -103.29 -14.64 8.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.707 0.289 . . . . 1.04 111.564 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.74 -44.61 93.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.427 -0.351 . . . . 1.09 111.323 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.27 -36.81 69.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.098 0.475 . . . . 1.13 111.016 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 5.8 tp10 -72.69 -58.61 3.22 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.598 -0.728 . . . . 1.56 110.62 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 96.2 t -54.91 -50.34 62.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.85 -0.614 . . . . 1.15 112.107 -178.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -58.24 -42.22 85.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.531 0.205 . . . . 2.15 111.355 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -67.66 -35.06 85.24 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.573 -0.823 . . . . 0.41 112.426 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 15.8 mmp_? -75.68 -48.76 20.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.548 0.213 . . . . 3.95 111.566 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 43.5 pt -65.97 -25.46 36.09 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 C-N-CA 121.062 -0.255 . . . . 1.22 111.589 -178.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -63.15 -21.79 66.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.432 0.634 . . . . 1.06 110.189 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -97.27 -33.73 11.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.722 -0.672 . . . . 1.57 110.804 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -76.3 -32.83 58.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 1.33 111.055 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -80.82 132.83 56.4 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.12 -0.491 . . . . 2.29 110.226 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -63.42 166.35 15.41 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.352 2.035 . . . . 1.47 110.835 178.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . 0.441 ' O ' ' HE2' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -59.44 -21.61 60.28 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.945 0.35 . . . . 5.56 111.945 -178.758 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.27 -25.79 51.8 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.831 0.348 . . . . 2.58 110.969 179.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 26.4 mt -98.66 -26.81 14.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.575 -0.284 . . . . 1.4 111.736 -178.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . 0.467 ' HA ' ' CD2' ' A' ' 106' ' ' LEU . 0.0 OUTLIER -61.13 -25.19 66.82 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.002 0.429 . . . . 2.83 110.541 -179.87 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.537 ' O ' ' HG3' ' A' ' 108' ' ' ARG . 53.2 mttm -65.48 -35.39 80.77 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.028 -0.533 . . . . 2.98 110.216 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 18.5 mtpp -69.94 -49.89 47.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.945 -0.57 . . . . 2.89 110.925 -179.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.467 ' CD2' ' HA ' ' A' ' 103' ' ' LYS . 3.2 pp -65.78 -27.92 68.63 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.684 0.278 . . . . 1.81 110.657 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.1 t -63.78 -37.64 88.13 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.265 -0.425 . . . . 1.53 110.03 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . 0.537 ' HG3' ' O ' ' A' ' 104' ' ' LYS . 8.3 mtp85 -66.42 -40.66 89.69 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.423 -0.584 . . . . 4.16 109.423 179.18 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.572 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 47.3 t -59.56 -56.95 13.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.159 -0.928 . . . . 1.81 110.732 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 44.7 t -57.85 -41.19 79.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.078 -0.51 . . . . 1.68 111.13 -179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -58.92 -49.08 79.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.301 -0.409 . . . . 2.24 110.524 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 96.9 mt -65.18 -38.3 82.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.712 0.291 . . . . 1.8 110.685 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 96.0 mt -59.67 -43.21 94.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.312 -0.404 . . . . 1.98 111.231 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -79.94 -33.25 39.81 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.899 -0.321 . . . . 2.17 111.07 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -66.0 -44.7 84.01 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.717 0.294 . . . . 2.2 111.022 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 85.8 mtt180 -87.03 7.27 28.44 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.548 -0.296 . . . . 3.8 111.103 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 47.84 58.89 4.59 Favored 'General case' 0 C--O 1.235 0.315 0 O-C-N 123.77 0.669 . . . . 2.23 110.84 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.452 ' HA ' ' HD2' ' A' ' 72' ' ' LYS . 40.4 mm -73.65 -48.02 42.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.855 -0.612 . . . . 1.26 110.939 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -101.93 174.76 5.8 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.024 -0.535 . . . . 2.11 110.838 -179.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' SER . . . . . 0.417 ' O ' HG22 ' A' ' 124' ' ' VAL . 26.7 t -71.18 139.6 50.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.058 -0.519 . . . . 1.55 109.761 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -53.23 -30.35 37.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.417 -0.356 . . . . 3.34 111.712 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 6.1 mm100 -61.92 -49.48 76.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.93 0.395 . . . . 3.37 111.132 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.532 ' O ' HG13 ' A' ' 127' ' ' ILE . 3.9 p -79.22 -27.89 13.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.301 -0.409 . . . . 1.92 111.032 -179.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.417 HG22 ' O ' ' A' ' 120' ' ' SER . 43.3 t -60.98 -42.21 92.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.206 0.527 . . . . 1.92 109.81 179.164 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -61.88 -37.89 86.27 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.442 -0.799 . . . . 2.18 110.391 179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -67.35 -36.48 81.5 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.142 -0.481 . . . . 1.44 110.452 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . 0.532 HG13 ' O ' ' A' ' 123' ' ' VAL . 70.1 mt -63.58 -49.33 82.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.084 0.469 . . . . 1.17 109.832 178.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -62.06 -40.1 94.64 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.743 -0.662 . . . . 2.05 110.544 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 41.7 mmt-85 -62.1 -43.47 98.77 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.255 -0.43 . . . . 4.63 110.354 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 50.7 m -64.44 -37.65 88.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.727 -0.67 . . . . 0.93 110.783 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 127' ' ' ILE . 73.5 mt -66.43 -46.01 77.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.35 -0.386 . . . . 2.04 110.88 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.14 -29.82 68.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 1.22 111.021 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.77 -21.77 64.85 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.028 -0.533 . . . . 1.45 111.727 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.421 . . . . 1.28 111.108 179.939 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.416 ' O ' HG22 ' A' ' 10' ' ' THR . 9.8 pt20 . . . . . 0 CA--C 1.527 0.073 0 CA-C-O 120.589 0.233 . . . . 3.17 111.252 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -75.16 -43.0 54.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.979 0.418 . . . . 1.44 110.052 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.97 -39.16 93.85 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.978 -0.556 . . . . 1.38 111.438 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' THR . . . . . 0.416 HG22 ' O ' ' A' ' 7' ' ' GLN . 1.2 t -69.83 -24.12 63.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.45 -0.341 . . . . 1.95 110.783 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -71.9 -36.83 70.14 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 109.996 -0.372 . . . . 1.78 109.996 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -68.08 -26.99 66.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.951 -0.568 . . . . 2.19 110.508 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -70.28 -34.34 72.66 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.742 -0.663 . . . . 1.96 110.464 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.6 t -105.2 17.19 24.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.903 -0.59 . . . . 2.11 110.442 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.2 126.88 31.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.863 -0.608 . . . . 1.63 110.291 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -115.29 151.99 33.56 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.663 -0.699 . . . . 2.16 109.557 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -80.19 40.53 0.49 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.506 0.67 . . . . 1.94 111.119 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.51 ' O ' HG12 ' A' ' 22' ' ' ILE . 3.5 m -107.18 146.66 31.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.561 -0.745 . . . . 1.89 110.063 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.1 -32.96 74.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.066 -0.515 . . . . 3.13 110.16 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -66.59 -49.67 65.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.069 -0.514 . . . . 2.99 109.838 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.437 ' OG ' ' HB2' ' A' ' 18' ' ' SER . 1.2 m -56.6 -48.77 76.71 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.905 -0.588 . . . . 1.62 111.777 -179.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.51 HG12 ' O ' ' A' ' 18' ' ' SER . 9.4 mm -64.44 -45.8 94.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.577 -0.283 . . . . 1.52 110.979 -179.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.7 m -66.4 -39.44 89.03 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 111.827 0.306 . . . . 1.63 111.827 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.0 t -59.64 -47.33 86.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.064 0.459 . . . . 1.4 110.152 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.36 -34.0 72.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.968 -0.56 . . . . 1.14 110.799 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.5 t -59.06 -52.67 64.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.175 -0.466 . . . . 1.62 110.283 179.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.7 mmtp -62.97 -37.95 89.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.093 -0.503 . . . . 2.76 110.395 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 20.6 t90 -61.7 -39.05 90.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.505 -0.77 . . . . 1.14 110.303 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -74.05 -42.23 60.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.715 -0.675 . . . . 1.91 110.515 179.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 mp -59.85 -23.26 63.24 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.093 -0.503 . . . . 1.71 111.585 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 78.3 mt -75.82 -32.04 59.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.458 -0.337 . . . . 2.2 110.528 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -103.08 48.12 0.86 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.58 0.705 . . . . 1.53 110.168 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.443 ' HA ' ' CE2' ' A' ' 79' ' ' PHE . 34.0 p90 -57.89 -23.24 52.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.259 -0.882 . . . . 2.35 112.09 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.7 mtp-105 -71.75 -18.73 62.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.912 0.387 . . . . 4.54 111.143 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.04 21.72 16.86 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.941 0.4 . . . . 1.7 110.817 -179.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.465 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.26 -49.45 84.9 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 115.446 -0.797 . . . . 1.06 112.521 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.575 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 35.3 Cg_endo -65.46 -34.56 42.66 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 121.548 1.499 . . . . 0.62 112.745 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.4 ttmt -66.47 -47.04 74.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.677 0.275 . . . . 3.25 111.688 -179.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.435 ' HA ' ' SD ' ' A' ' 42' ' ' MET . 26.9 m -73.14 -22.93 19.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 C-N-CA 120.777 -0.369 . . . . 1.12 111.053 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.422 ' HA ' ' CE1' ' A' ' 83' ' ' PHE . . . -71.94 -50.1 31.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.391 -0.368 . . . . 0.99 111.029 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.575 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 5.0 pt-20 -63.69 -44.32 94.05 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.347 -0.388 . . . . 1.4 111.283 -179.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.435 ' SD ' ' HA ' ' A' ' 39' ' ' VAL . 16.5 ptm -65.88 -33.44 75.85 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.484 0.183 . . . . 2.13 110.915 -179.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 64.7 t90 -64.94 -45.49 85.56 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.158 -0.682 . . . . 0.47 109.158 178.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.464 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 16.9 ttpt -60.16 -49.5 77.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.277 -0.874 . . . . 1.71 110.426 179.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.51 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 6.7 mm-40 -58.48 -42.51 87.71 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.04 0.448 . . . . 1.96 110.58 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -63.66 -42.75 98.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.761 -0.654 . . . . 2.37 111.217 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 71.6 mmm -72.74 -23.6 60.86 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.129 -0.487 . . . . 1.15 112.311 -178.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 71.0 mt -85.27 -16.8 38.92 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 111.942 0.349 . . . . 1.39 111.942 -179.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.51 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 57.0 mtm180 -70.67 133.85 86.48 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.737 0.304 . . . . 3.14 111.401 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.2 -13.63 20.95 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.858 2.372 . . . . 1.07 112.37 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -9.68 58.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.988 -0.551 . . . . 1.64 110.793 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 34.0 t -104.63 125.81 59.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.796 -0.638 . . . . 1.17 109.743 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -72.74 163.28 28.35 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.057 0.456 . . . . 2.2 111.005 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.22 -34.44 73.66 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.123 0.786 . . . . 1.52 113.123 -178.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -62.6 -43.92 97.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.769 0.319 . . . . 4.09 110.68 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -65.28 -37.38 87.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 3.61 110.359 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -65.77 -36.15 82.74 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.908 -0.587 . . . . 1.15 110.327 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 32.9 tp -62.85 -41.32 99.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.125 -0.489 . . . . 1.87 110.032 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.4 mp -69.39 -35.98 76.32 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.03 -0.532 . . . . 2.11 110.16 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.11 -32.46 84.12 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.758 -0.734 . . . . 0.4 111.313 178.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 37.2 tp -68.16 -37.13 80.67 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.97 0.414 . . . . 1.88 110.218 179.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -64.57 -39.47 93.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.842 -0.617 . . . . 2.18 110.499 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.0 tp -63.67 -44.61 93.26 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.082 -0.508 . . . . 2.19 110.481 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.469 ' O ' HG21 ' A' ' 68' ' ' VAL . 13.6 tmm? -60.13 -41.58 92.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.013 -0.54 . . . . 1.17 109.763 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.488 ' O ' ' HB2' ' A' ' 69' ' ' GLN . 1.4 t30 -60.05 -41.74 92.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.601 -0.727 . . . . 2.22 111.301 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -67.79 -47.72 68.32 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.114 0.413 . . . . 2.15 112.114 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 31.1 m -63.33 -32.13 55.35 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 112.669 0.618 . . . . 2.07 112.669 -178.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.469 HG21 ' O ' ' A' ' 64' ' ' MET . 34.2 m -88.59 -18.96 7.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.613 -0.435 . . . . 1.18 111.09 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.488 ' HB2' ' O ' ' A' ' 65' ' ' ASN . 6.2 tp-100 -76.77 -49.35 16.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 2.59 110.831 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 55.4 mm-40 -82.16 -6.15 58.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.185 -0.461 . . . . 2.55 111.035 -179.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.3 -33.47 72.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.317 -0.401 . . . . 1.16 111.519 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -67.02 -28.68 68.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.65 -0.25 . . . . 2.55 111.24 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.56 -38.53 95.83 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.918 -0.658 . . . . 0.66 111.93 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -100.57 0.82 40.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.653 0.263 . . . . 1.91 110.743 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? 63.02 37.75 11.47 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.824 -0.626 . . . . 3.18 111.009 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.4 mm -92.32 81.86 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.367 0.603 . . . . 1.2 109.755 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 44.1 pt -73.78 -11.37 14.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.616 -0.72 . . . . 1.4 111.249 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -61.8 -47.57 84.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.11 -0.496 . . . . 2.37 110.628 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.443 ' CE2' ' HA ' ' A' ' 33' ' ' TYR . 8.7 m-85 -64.92 -33.96 77.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.303 -0.408 . . . . 2.23 111.214 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -71.58 -26.49 62.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.989 -0.551 . . . . 1.45 111.32 -179.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -87.26 -41.92 13.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.723 0.297 . . . . 1.32 110.542 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' SER . . . . . 0.442 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 35.0 p -67.3 -52.52 39.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.326 -0.397 . . . . 1.18 111.001 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.422 ' CE1' ' HA ' ' A' ' 40' ' ' ALA . 18.9 m-85 -74.31 -31.54 62.52 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.323 -0.398 . . . . 2.13 110.712 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -63.14 -43.64 98.37 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.166 -0.54 . . . . 0.34 113.39 -179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.442 ' HE2' ' HA ' ' A' ' 82' ' ' SER . 0.1 OUTLIER -65.47 -24.79 67.25 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.254 0.465 . . . . 1.9 112.254 -178.627 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.7 m -104.77 -9.86 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 C-N-CA 120.894 -0.322 . . . . 1.04 111.364 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.22 -48.73 80.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.267 -0.424 . . . . 1.09 111.432 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.04 -41.76 88.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.157 -0.474 . . . . 1.13 111.359 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -62.33 -50.31 72.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.888 -0.596 . . . . 1.56 110.464 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 92.9 t -65.32 -41.31 91.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.957 -0.565 . . . . 1.15 110.936 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -60.87 -48.29 82.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.501 -0.318 . . . . 2.15 111.101 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -64.9 -25.47 70.69 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.589 -0.815 . . . . 0.41 111.879 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.581 ' O ' ' HG2' ' A' ' 96' ' ' GLN . 3.8 mmm-85 -78.87 -51.75 9.26 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.435 0.16 . . . . 3.95 111.21 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 46.2 pt -68.09 -22.26 27.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.926 -0.31 . . . . 1.22 111.241 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -65.51 -28.06 68.92 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.927 0.394 . . . . 1.06 110.742 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.581 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 10.0 pt20 -98.49 -11.84 21.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.031 0.443 . . . . 1.57 110.767 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -91.43 -37.61 13.09 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.153 -0.476 . . . . 1.33 110.628 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -72.99 130.2 85.36 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.265 -0.425 . . . . 2.29 109.933 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -52.55 -77.1 0.02 OUTLIER 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 123.317 2.678 . . . . 1.47 113.298 -179.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -155.8 -53.94 0.09 Allowed 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 111.905 0.335 . . . . 5.56 111.905 179.478 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -65.24 -33.38 75.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.038 0.447 . . . . 2.58 110.838 -179.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 79.5 mt -74.13 -39.01 63.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.174 -0.466 . . . . 1.4 110.875 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . 0.478 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 10.6 ptpt -73.11 -8.75 57.14 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 121.336 0.589 . . . . 2.83 110.392 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -81.05 -10.76 59.64 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.361 -0.836 . . . . 2.98 109.539 178.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -95.26 -30.06 14.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.722 -0.672 . . . . 2.89 111.308 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 103' ' ' LYS . 4.2 pp -69.78 -28.27 65.62 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 121.056 0.455 . . . . 1.81 110.233 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.04 -34.57 76.71 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.979 -0.555 . . . . 1.53 110.126 179.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 108' ' ' ARG . 40.0 mmt180 -66.57 -51.62 54.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.556 -0.747 . . . . 4.16 111.051 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.439 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 2.7 p -65.28 -40.26 88.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.423 -0.353 . . . . 1.81 110.699 -179.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 6.3 t -62.5 -42.8 97.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.864 0.364 . . . . 1.68 110.046 179.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -59.26 -47.83 83.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.866 -0.607 . . . . 2.24 109.953 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.423 ' O ' ' HG2' ' A' ' 116' ' ' ARG . 96.8 mt -60.7 -49.72 83.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.996 -0.547 . . . . 1.8 111.335 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 96.0 mt -59.87 -39.15 84.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.331 -0.395 . . . . 1.98 111.963 -178.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 4.7 pttp -82.23 -22.93 35.63 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.549 -0.46 . . . . 2.17 111.769 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -78.79 -37.0 41.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.923 0.392 . . . . 2.2 110.48 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . 0.423 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 13.4 mmm-85 -84.67 1.37 46.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.083 -0.508 . . . . 3.8 110.288 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 11.5 m120 57.79 47.79 14.84 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.435 -0.802 . . . . 2.23 111.034 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 31.6 mm -70.17 -50.45 47.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.907 -0.588 . . . . 1.26 109.801 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -100.38 158.79 15.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.901 -0.591 . . . . 2.11 110.309 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.8 m -67.32 156.02 37.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.194 -0.457 . . . . 1.55 109.945 179.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 61.3 mtpt -55.77 -34.29 65.12 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.945 0.35 . . . . 3.34 111.945 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -59.54 -41.83 90.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.184 0.516 . . . . 3.37 110.02 179.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.43 ' O ' HG13 ' A' ' 127' ' ' ILE . 40.7 t -72.27 -45.01 62.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.578 -0.737 . . . . 1.92 110.301 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 76.8 t -57.87 -44.07 85.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.496 . . . . 1.92 110.932 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 42.4 t-20 -58.01 -45.76 86.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.923 -0.58 . . . . 2.18 110.259 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -62.96 -38.82 92.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.984 -0.553 . . . . 1.44 111.305 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 123' ' ' VAL . 79.9 mt -66.75 -46.67 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.091 0.472 . . . . 1.17 110.775 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 68.5 mt-10 -63.17 -28.86 70.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.151 -0.477 . . . . 2.05 110.952 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.441 HH11 ' HD3' ' A' ' 129' ' ' ARG . 21.5 mtm-85 -81.11 -41.08 23.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.24 -0.437 . . . . 4.63 111.984 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 1.2 p -62.71 -33.72 75.69 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.002 0.43 . . . . 0.93 110.654 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.6 mp -68.5 -44.25 75.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.169 -0.469 . . . . 2.04 110.401 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.84 -37.83 76.29 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.044 -0.526 . . . . 1.22 111.735 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -64.44 -19.43 65.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.936 0.398 . . . . 1.45 111.426 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 116.109 -0.496 . . . . 1.28 111.281 179.793 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.519 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 19.8 mm100 . . . . . 0 C--O 1.226 -0.165 0 CA-C-O 121.067 0.461 . . . . 3.17 110.644 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.504 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 78.5 t80 -79.93 -42.58 23.77 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.923 -0.581 . . . . 1.44 109.693 179.114 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.1 m -65.34 -34.54 78.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.65 -0.705 . . . . 1.38 111.494 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.07 -35.53 81.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.003 0.43 . . . . 1.95 110.719 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 31.1 mmmt -76.23 -38.81 55.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.056 -0.52 . . . . 1.78 110.584 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -60.97 -29.03 69.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.25 -0.432 . . . . 2.19 111.499 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 -83.76 -5.97 59.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.309 -0.405 . . . . 1.96 111.855 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.462 HG21 ' O ' ' A' ' 11' ' ' LYS . 3.6 t -115.81 -3.27 12.23 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.669 -0.412 . . . . 2.11 111.44 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 32.5 mt -72.93 163.07 28.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.52 -0.309 . . . . 1.63 111.03 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -143.67 -170.26 3.26 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.708 -0.479 . . . . 2.16 109.708 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -76.67 -19.28 57.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.198 0.523 . . . . 1.94 110.379 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.56 116.88 2.91 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.587 -0.733 . . . . 1.89 110.782 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.47 -35.22 65.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.769 -0.651 . . . . 3.13 110.784 -179.485 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -65.7 -34.09 77.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.853 -0.612 . . . . 2.99 110.967 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.5 p -71.41 -40.11 70.69 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.575 -0.528 . . . . 1.62 109.575 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.1 mm -66.59 -44.18 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 CA-C-N 115.91 -0.587 . . . . 1.52 109.77 179.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 56.0 m -59.58 -38.01 80.02 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.971 -0.559 . . . . 1.63 111.173 179.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.3 m -67.9 -28.69 67.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.809 0.338 . . . . 1.4 110.832 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.78 -44.26 15.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.255 -0.43 . . . . 1.14 111.113 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.4 p -62.44 -44.01 97.45 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.726 0.298 . . . . 1.62 110.651 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -64.66 -36.96 85.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.982 0.42 . . . . 2.76 110.536 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -67.44 -36.16 80.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.267 0.556 . . . . 1.14 109.539 178.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -70.86 -39.41 72.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.715 -0.675 . . . . 1.91 110.559 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.0 mt -62.28 -24.91 67.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.303 -0.408 . . . . 1.71 110.739 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 24.0 mt -78.55 -16.38 57.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.99 -0.55 . . . . 2.2 111.338 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -120.58 46.5 1.98 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.075 0.464 . . . . 1.53 110.659 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -62.81 -9.69 10.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 2.35 111.386 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 77.5 mtt180 -66.28 -35.42 80.34 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.218 0.532 . . . . 4.54 110.088 178.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -103.79 27.63 7.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.617 -0.719 . . . . 1.7 110.86 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.466 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.51 -51.32 74.15 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.736 -0.665 . . . . 1.06 111.852 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 33.4 Cg_endo -64.5 -28.64 61.92 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 121.617 1.544 . . . . 0.62 112.089 179.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.1 tppt? -72.77 -46.27 54.27 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.023 -0.535 . . . . 3.25 111.185 -179.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 35.5 m -72.19 -25.23 23.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 C-N-CA 120.924 -0.311 . . . . 1.12 110.521 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.01 -49.2 62.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 0.99 110.494 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -68.91 -33.87 74.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.986 -0.552 . . . . 1.4 110.098 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.504 ' SD ' ' HB3' ' A' ' 8' ' ' PHE . 39.2 ttm -66.41 -40.05 89.34 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.935 -0.575 . . . . 2.13 109.916 179.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 51.5 t90 -62.48 -47.33 84.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.493 -0.776 . . . . 0.47 109.566 178.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 38.9 tttt -56.62 -47.71 79.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.384 -0.826 . . . . 1.71 110.802 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' A' ' 49' ' ' ARG . 12.4 mm-40 -57.95 -44.68 87.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.044 -0.526 . . . . 1.96 111.304 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -66.18 -44.46 83.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 2.37 111.353 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 84.8 mmm -66.32 -29.62 69.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.303 -0.408 . . . . 1.15 111.577 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.2 mt -92.73 19.4 7.55 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.796 0.331 . . . . 1.39 111.365 -179.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.574 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 36.1 mmt-85 -87.08 133.88 38.04 Favored Pre-proline 0 C--N 1.328 -0.353 0 N-CA-C 110.011 -0.366 . . . . 3.14 110.011 178.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -74.34 -22.34 16.47 Favored 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.51 2.14 . . . . 1.07 112.397 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.3 m -83.3 -16.18 47.23 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.244 -0.435 . . . . 1.64 111.456 -179.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.6 t -77.76 127.36 38.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.122 0.486 . . . . 1.17 110.794 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -66.55 149.13 50.91 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.437 -0.801 . . . . 2.2 111.137 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.48 -39.46 70.43 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.097 0.406 . . . . 1.52 112.097 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 42.0 mtm105 -67.82 -29.73 68.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.877 0.37 . . . . 4.09 110.682 -179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -69.3 -36.67 77.26 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.642 -0.503 . . . . 3.61 109.642 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 50.8 mttt -70.03 -33.15 71.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.695 -0.684 . . . . 1.15 109.291 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 19.9 tp -62.66 -41.01 98.83 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.667 -0.697 . . . . 1.87 109.811 178.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.9 mp -67.64 -36.99 81.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.468 -0.787 . . . . 2.11 109.997 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.17 -30.19 75.36 Favored Glycine 0 C--N 1.331 0.293 0 CA-C-N 115.802 -0.635 . . . . 0.4 111.604 179.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 8.3 mt -63.84 -44.63 92.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.882 0.372 . . . . 1.88 110.216 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -62.56 -39.22 92.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.672 -0.695 . . . . 2.18 110.548 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -61.25 -48.87 79.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.94 -0.573 . . . . 2.19 110.618 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.444 ' O ' HG13 ' A' ' 67' ' ' VAL . 14.7 tmm? -62.38 -48.56 79.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 1.17 110.295 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -58.5 -41.59 85.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.794 -0.639 . . . . 2.22 111.382 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -68.03 -47.72 67.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.157 -0.474 . . . . 2.15 111.612 -179.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.444 HG13 ' O ' ' A' ' 64' ' ' MET . 8.2 p -64.28 -36.29 76.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 112.645 0.609 . . . . 2.07 112.645 -177.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.406 HG21 ' O ' ' A' ' 64' ' ' MET . 35.7 m -78.27 -26.07 14.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 C-N-CA 120.726 -0.39 . . . . 1.18 111.28 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -52.07 20.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.018 0.437 . . . . 2.59 109.848 179.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 26.6 mm100 -72.27 -15.21 61.91 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.058 -0.519 . . . . 2.55 110.925 -179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.79 -25.68 68.02 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.261 -0.427 . . . . 1.16 110.56 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.488 ' HG2' ' NE2' ' A' ' 80' ' ' GLN . 19.5 mtpt -70.63 -21.04 62.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.335 -0.393 . . . . 2.55 110.443 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.21 -43.69 31.44 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.967 -0.635 . . . . 0.66 112.177 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -91.47 -0.85 57.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.742 0.306 . . . . 1.91 110.616 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp 62.98 46.09 4.99 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.429 -0.805 . . . . 3.18 111.132 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 31.9 mm -95.89 78.7 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.921 -0.582 . . . . 1.2 110.124 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.559 ' HA ' ' OE1' ' A' ' 80' ' ' GLN . 15.4 pt -68.51 -16.3 20.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.713 -0.676 . . . . 1.4 110.295 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -61.48 -37.9 85.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.542 -0.754 . . . . 2.37 110.541 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.425 ' O ' ' HB2' ' A' ' 83' ' ' PHE . 0.8 OUTLIER -72.42 -42.13 65.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.017 -0.538 . . . . 2.23 111.173 -179.406 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.559 ' OE1' ' HA ' ' A' ' 77' ' ' ILE . 21.6 mt-30 -68.94 -27.47 65.77 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.081 -0.509 . . . . 1.45 111.511 -178.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.558 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 5.6 t70 -76.02 -49.21 18.23 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.97 0.415 . . . . 1.32 110.125 178.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.7 p -67.64 -49.15 64.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.022 -0.535 . . . . 1.18 111.516 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.425 ' HB2' ' O ' ' A' ' 79' ' ' PHE . 4.4 m-85 -71.36 -30.7 66.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.59 -0.277 . . . . 2.13 111.239 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.85 -52.03 54.93 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.107 -0.568 . . . . 0.34 113.785 -179.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.558 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 10.0 ptpt -60.26 -36.67 78.32 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.072 0.397 . . . . 1.9 112.072 -178.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.8 m -82.8 -28.01 8.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 C-N-CA 120.667 -0.413 . . . . 1.04 111.124 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 91' ' ' LEU . . . -62.14 -41.2 98.03 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.639 -0.255 . . . . 1.09 110.934 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.09 -33.9 69.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.028 0.442 . . . . 1.13 111.125 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -83.39 -52.46 6.51 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.909 -0.587 . . . . 1.56 110.873 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.5 ' O ' HG12 ' A' ' 94' ' ' ILE . 75.7 t -57.56 -50.83 75.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.093 -0.503 . . . . 1.15 111.997 -178.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.414 ' HB2' ' O ' ' A' ' 87' ' ' ALA . 8.5 mp -61.52 -38.52 87.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.692 -0.231 . . . . 2.15 111.087 -178.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -70.88 -28.82 70.02 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.506 -0.854 . . . . 0.41 112.005 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.521 ' O ' ' HG2' ' A' ' 96' ' ' GLN . 1.3 mmm-85 -78.02 -51.45 10.32 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.646 0.26 . . . . 3.95 111.063 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.5 HG12 ' O ' ' A' ' 90' ' ' VAL . 32.8 pt -70.78 -15.85 19.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.523 -0.308 . . . . 1.22 111.615 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -58.19 -34.16 70.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.018 0.437 . . . . 1.06 110.675 179.301 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 4.3 pt20 -96.56 1.74 51.64 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.155 -0.475 . . . . 1.57 110.799 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -100.67 -31.23 11.32 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.15 0.5 . . . . 1.33 109.965 179.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -81.67 131.76 56.82 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.518 -0.765 . . . . 2.29 111.11 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -65.1 167.6 15.8 Favored 'Trans proline' 0 CA--C 1.529 0.271 0 C-N-CA 122.699 2.266 . . . . 1.47 111.724 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 13.3 mmm180 -47.82 -40.57 21.51 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.852 0.686 . . . . 5.56 112.852 -179.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -71.53 -47.81 52.76 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.002 0.371 . . . . 2.58 112.002 -179.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 30.7 mt -70.94 -39.59 72.54 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.857 0.317 . . . . 1.4 111.857 -178.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -71.15 -17.73 62.54 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.766 -0.374 . . . . 2.83 110.629 -179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -67.22 -34.38 77.35 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.182 -1.044 . . . . 2.98 108.182 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.4 ' O ' HG22 ' A' ' 109' ' ' VAL . 74.0 mmtt -76.49 -37.05 57.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.178 -0.919 . . . . 2.89 109.064 178.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 35.4 tp -59.58 -37.58 78.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.549 -0.75 . . . . 1.81 109.974 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.54 ' O ' ' HB2' ' A' ' 111' ' ' ASN . 36.7 m -61.04 -37.48 82.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.619 -0.719 . . . . 1.53 110.328 179.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.9 mtt180 -70.24 -38.19 75.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 4.16 110.555 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.431 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 61.8 t -60.9 -57.2 13.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.039 -0.528 . . . . 1.81 110.719 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 10.8 p -65.18 -28.97 45.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.182 -0.463 . . . . 1.68 111.054 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . 0.54 ' HB2' ' O ' ' A' ' 107' ' ' SER . 56.0 t30 -60.33 -55.71 30.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.248 -0.433 . . . . 2.24 110.307 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 95.7 mt -62.95 -36.19 74.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.092 -0.504 . . . . 1.8 111.154 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 71.5 mt -56.36 -42.8 78.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.363 -0.38 . . . . 1.98 111.764 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.78 -29.32 19.86 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.816 -0.353 . . . . 2.17 111.372 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -65.57 -38.55 89.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.764 0.316 . . . . 2.2 111.561 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 7.9 mmm180 -96.11 5.61 50.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.347 -0.388 . . . . 3.8 111.012 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.0 m120 52.22 57.75 6.13 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.391 0.615 . . . . 2.23 110.901 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 43.2 mm -76.13 -33.63 24.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.552 -0.749 . . . . 1.26 110.286 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -110.47 171.91 7.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.776 -0.647 . . . . 2.11 110.811 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.0 t -69.65 146.98 51.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.744 -0.662 . . . . 1.55 109.932 179.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 50.7 pttt -59.47 -27.48 66.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.759 0.281 . . . . 3.34 111.759 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -68.78 -44.23 74.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.842 0.353 . . . . 3.37 110.817 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.536 ' O ' HG13 ' A' ' 127' ' ' ILE . 9.1 p -82.47 -28.42 8.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.416 -0.356 . . . . 1.92 110.912 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 7.3 t -61.26 -43.22 96.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 109.633 -0.506 . . . . 1.92 109.633 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -64.7 -35.43 81.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.674 -0.694 . . . . 2.18 109.963 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -63.57 -41.26 98.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.872 -0.604 . . . . 1.44 110.219 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 123' ' ' VAL . 63.6 mt -62.73 -53.99 39.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.799 -0.637 . . . . 1.17 111.334 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -63.55 -36.54 84.12 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 120.994 -0.282 . . . . 2.05 111.08 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -61.98 -39.74 93.22 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.847 -0.427 . . . . 4.63 109.847 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 44.6 m -67.53 -39.77 85.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.916 -0.583 . . . . 0.93 110.493 179.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.0 mt -69.16 -29.45 67.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.094 -0.503 . . . . 2.04 110.927 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -78.78 -37.79 40.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.197 -0.456 . . . . 1.22 110.503 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.02 -19.26 62.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.829 -0.623 . . . . 1.45 111.782 -179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.432 -0.349 . . . . 1.28 111.072 -179.85 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 . . . . . 0 CA--C 1.531 0.22 0 CA-C-O 120.926 0.393 . . . . 3.17 111.724 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -68.54 -42.56 78.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.05 0.452 . . . . 1.44 111.206 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.92 -42.49 94.04 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.964 0.727 . . . . 1.38 112.964 -178.57 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.11 -21.92 61.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.61 0.243 . . . . 1.95 111.385 -179.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -69.49 -36.74 76.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.74 0.305 . . . . 1.78 110.42 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -64.97 -28.88 69.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.236 0.541 . . . . 2.19 110.708 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -78.9 -10.59 59.86 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.673 -0.694 . . . . 1.96 110.919 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.59 36.28 4.64 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.171 0.51 . . . . 2.11 111.155 -179.529 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.9 mt -112.36 163.2 14.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.051 0.453 . . . . 1.63 111.286 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -134.06 160.77 36.76 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.571 -0.74 . . . . 2.16 109.133 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -79.82 29.31 0.26 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.777 0.323 . . . . 1.94 111.701 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.518 ' HB2' ' OG ' ' A' ' 21' ' ' SER . 68.6 m -93.32 140.95 28.99 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.179 -0.304 . . . . 1.89 110.179 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.49 -52.86 63.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.121 -0.491 . . . . 3.13 110.333 -179.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -61.48 -40.77 95.76 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.908 -0.587 . . . . 2.99 111.775 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.518 ' OG ' ' HB2' ' A' ' 18' ' ' SER . 18.1 m -59.25 -49.1 79.13 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.765 0.316 . . . . 1.62 110.968 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.1 mm -64.1 -41.91 93.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.726 -0.472 . . . . 1.52 109.726 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.6 m -59.04 -40.88 86.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.928 -0.578 . . . . 1.63 111.01 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.3 m -61.26 -47.16 87.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 1.4 110.825 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.38 -42.0 79.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.347 -0.388 . . . . 1.14 111.052 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 19.1 m -62.7 -36.64 83.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.28 -0.418 . . . . 1.62 111.244 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.9 ttpt -61.24 -40.91 95.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.811 0.339 . . . . 2.76 110.532 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 33.1 t90 -68.59 -38.24 80.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.955 0.407 . . . . 1.14 109.916 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -64.12 -41.06 97.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.796 -0.638 . . . . 1.91 110.756 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.66 -33.24 73.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.119 -0.491 . . . . 1.71 110.732 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 74.8 mt -73.04 -25.18 60.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.968 -0.56 . . . . 2.2 110.308 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 70.9 mm-40 -97.93 48.42 1.01 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.044 -0.525 . . . . 1.53 110.613 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.448 ' HA ' ' CZ ' ' A' ' 79' ' ' PHE . 6.6 p90 -59.71 -21.31 60.44 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.681 -0.69 . . . . 2.35 111.614 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -75.64 -14.77 60.38 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.28 -0.418 . . . . 4.54 111.363 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -109.44 12.72 24.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.778 0.323 . . . . 1.7 110.899 -179.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.448 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -51.45 -51.02 73.17 Favored Pre-proline 0 CA--C 1.538 0.483 0 CA-C-N 115.903 -0.59 . . . . 1.06 112.414 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.448 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 39.3 Cg_endo -66.07 -19.92 57.19 Favored 'Trans proline' 0 C--N 1.357 0.978 0 C-N-CA 121.888 1.725 . . . . 0.62 112.831 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.7 tptm -88.28 -46.26 9.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.672 0.272 . . . . 3.25 110.821 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.2 m -67.44 -28.36 41.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.964 -0.294 . . . . 1.12 110.854 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.98 -46.77 80.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.362 -0.381 . . . . 0.99 111.337 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -70.41 -38.09 74.56 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.891 -0.324 . . . . 1.4 110.454 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 68.8 mtm -63.12 -41.91 99.42 Favored 'General case' 0 CA--C 1.521 -0.168 0 N-CA-C 109.98 -0.378 . . . . 2.13 109.98 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 71.1 t90 -61.95 -48.57 79.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.616 -0.72 . . . . 0.47 110.256 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.496 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 16.1 ttpt -58.71 -49.51 77.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.807 -0.633 . . . . 1.71 110.65 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.485 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 57.7 mm-40 -60.85 -42.3 97.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.886 -0.597 . . . . 1.96 111.087 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 76.3 t80 -62.65 -47.7 82.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.104 -0.498 . . . . 2.37 111.109 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.444 ' HE2' ' O ' ' A' ' 57' ' ' LYS . 74.6 mmm -64.55 -20.8 66.45 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.26 -0.427 . . . . 1.15 111.988 -179.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 64.0 mt -97.63 0.12 46.67 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.626 0.232 . . . . 1.39 111.626 -179.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 27.0 mtp180 -79.03 135.64 58.42 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.628 0.251 . . . . 3.14 110.528 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.12 5.95 3.28 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.909 2.406 . . . . 1.07 112.81 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.1 m -103.22 8.23 38.46 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.097 -0.501 . . . . 1.64 110.347 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.5 t -111.54 123.6 67.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.984 -0.553 . . . . 1.17 111.065 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -73.3 153.7 40.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.0 -0.545 . . . . 2.2 110.641 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.09 -32.56 62.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 1.52 112.193 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -42.37 98.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.875 0.369 . . . . 4.09 110.79 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.9 mtm-85 -71.57 -29.8 65.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.246 -0.434 . . . . 3.61 110.617 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.444 ' O ' ' HE2' ' A' ' 47' ' ' MET . 54.2 mttt -65.28 -34.43 78.33 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.334 -0.617 . . . . 1.15 109.334 178.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 21.4 tp -67.53 -41.25 84.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.803 -0.635 . . . . 1.87 109.315 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.7 mp -63.75 -44.83 92.32 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.291 -0.868 . . . . 2.11 110.032 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.16 -35.39 91.46 Favored Glycine 0 C--N 1.333 0.383 0 CA-C-N 115.845 -0.616 . . . . 0.4 111.949 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.36 -44.31 91.82 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.666 -0.494 . . . . 1.88 109.666 179.011 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -65.81 -34.47 78.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.801 -0.636 . . . . 2.18 111.114 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 39.3 tp -63.84 -44.14 94.07 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.76 -0.459 . . . . 2.19 109.76 178.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.434 ' O ' HG23 ' A' ' 68' ' ' VAL . 15.8 tmm? -64.97 -44.32 89.77 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.688 -0.687 . . . . 1.17 109.897 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -57.67 -39.7 77.68 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.817 -0.628 . . . . 2.22 110.999 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -67.04 -52.73 38.62 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.081 -0.509 . . . . 2.15 111.44 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 31.5 m -63.18 -34.89 69.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 112.817 0.673 . . . . 2.07 112.817 -178.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 64' ' ' MET . 34.6 m -78.5 -24.77 13.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 C-N-CA 120.276 -0.57 . . . . 1.18 110.969 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -76.74 -45.81 27.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.155 0.502 . . . . 2.59 109.953 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -75.29 -16.36 60.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.617 -0.719 . . . . 2.55 110.819 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.47 -33.99 73.38 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 116.06 -0.518 . . . . 1.16 110.682 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.489 ' HG2' HE22 ' A' ' 80' ' ' GLN . 1.8 mmtp -68.35 -27.32 66.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 2.55 110.347 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.01 -46.37 73.77 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.932 -0.576 . . . . 0.66 111.801 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -87.38 -6.56 58.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.981 0.42 . . . . 1.91 110.352 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.88 27.17 9.09 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.25 -0.886 . . . . 3.18 111.668 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.7 mm -94.44 87.71 2.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 109.343 -0.614 . . . . 1.2 109.343 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 18.2 pt -72.33 -8.8 12.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.901 -0.59 . . . . 1.4 111.796 -178.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -60.16 -33.38 72.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.918 0.389 . . . . 2.37 110.388 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.448 ' CZ ' ' HA ' ' A' ' 33' ' ' TYR . 29.7 m-85 -69.04 -48.72 62.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.873 -0.603 . . . . 2.23 109.615 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.489 HE22 ' HG2' ' A' ' 72' ' ' LYS . 86.0 mt-30 -65.19 -32.13 73.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.301 -0.863 . . . . 1.45 111.553 -179.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.495 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 9.5 t70 -72.74 -53.64 11.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.834 0.349 . . . . 1.32 110.406 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.4 m -63.65 -42.58 98.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.062 -0.517 . . . . 1.18 111.774 -179.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -78.35 -29.19 47.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.616 -0.265 . . . . 2.13 110.977 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -64.95 -41.65 97.26 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 121.049 -0.596 . . . . 0.34 113.346 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.495 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 12.8 ptpt -68.82 -18.34 64.15 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.042 0.386 . . . . 1.9 112.042 -178.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 32.6 m -107.95 -19.91 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 121.008 -0.277 . . . . 1.04 111.222 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.13 95.6 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.431 -0.35 . . . . 1.09 110.96 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.73 -44.2 73.33 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.077 -0.511 . . . . 1.13 110.624 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.4 tp10 -63.68 -58.72 6.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.601 -0.727 . . . . 1.56 110.208 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.48 ' O ' HG12 ' A' ' 94' ' ' ILE . 80.7 t -54.03 -50.27 55.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.761 -0.654 . . . . 1.15 111.994 -179.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 81.7 mt -60.97 -42.5 98.42 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.641 0.237 . . . . 2.15 111.641 -179.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -67.86 -25.02 74.33 Favored Glycine 0 CA--C 1.519 0.318 0 C-N-CA 120.718 -0.753 . . . . 0.41 112.241 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 33.5 mmm-85 -83.31 -55.05 4.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.641 0.258 . . . . 3.95 111.213 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 90' ' ' VAL . 30.6 pt -66.38 -19.8 26.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 112.359 0.503 . . . . 1.22 112.359 -178.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.1 t30 -63.45 -24.27 67.76 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.256 0.551 . . . . 1.06 110.31 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -90.74 -14.1 32.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.058 -0.519 . . . . 1.57 110.73 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -101.91 -28.69 12.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.03 -0.532 . . . . 1.33 111.048 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -70.26 121.76 84.21 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.166 -0.47 . . . . 2.29 111.411 -179.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -68.64 175.91 6.54 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.417 2.078 . . . . 1.47 111.822 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . 0.439 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 13.5 ptt-85 -53.02 -27.67 20.53 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.052 -0.522 . . . . 5.56 112.106 -179.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -76.37 -48.42 19.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.028 0.442 . . . . 2.58 111.776 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 22.3 mt -76.7 -35.36 57.93 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.737 0.643 . . . . 1.4 112.737 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 6.0 pttp -64.89 -25.22 67.8 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.733 -0.387 . . . . 2.83 110.993 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 100' ' ' ARG . 47.6 mtmt -66.31 -37.74 86.08 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.221 -0.659 . . . . 2.98 109.221 178.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -75.68 -34.26 60.42 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.162 -0.926 . . . . 2.89 109.798 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 7.0 tt -63.79 -41.99 97.82 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.417 -0.81 . . . . 1.81 109.985 178.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 21.0 m -62.58 -32.5 73.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.126 -0.488 . . . . 1.53 110.611 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 70.6 mtt180 -67.17 -55.43 14.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.028 -0.533 . . . . 4.16 111.286 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 7.7 p -62.48 -42.5 95.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.307 -0.406 . . . . 1.81 111.983 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.72 -40.56 82.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 120.836 0.35 . . . . 1.68 110.555 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . 0.441 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 11.9 t-20 -61.28 -48.56 80.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.867 -0.606 . . . . 2.24 110.637 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 63.3 mt -61.12 -46.71 96.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.281 -0.418 . . . . 1.8 111.347 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 96.3 mt -59.12 -42.49 90.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.094 -0.503 . . . . 1.98 112.291 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 111' ' ' ASN . 1.2 ptpt -78.48 -33.31 48.31 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.054 0.39 . . . . 2.17 112.054 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -75.62 -39.2 58.19 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.906 0.336 . . . . 2.2 111.906 -178.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -79.96 -1.15 38.24 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.033 0.444 . . . . 3.8 110.801 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 60.8 50.76 5.18 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.589 -0.732 . . . . 2.23 111.454 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 45.9 mm -72.47 -40.6 63.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.091 0.472 . . . . 1.26 110.235 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -109.52 173.85 6.13 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.938 -0.574 . . . . 2.11 109.835 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.78 162.69 29.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.175 -0.466 . . . . 1.55 110.863 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 15.2 mmmt -52.74 -50.27 63.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.17 -0.468 . . . . 3.34 111.292 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -56.37 -34.45 66.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.843 -0.617 . . . . 3.37 112.072 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 61.6 t -80.14 -49.58 18.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.793 0.294 . . . . 1.92 111.793 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 34.7 m -62.63 -29.74 47.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 C-N-CA 120.964 -0.294 . . . . 1.92 111.159 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -78.92 -27.16 43.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.931 0.395 . . . . 2.18 110.819 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.459 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 44.8 t0 -76.63 -41.25 46.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.267 0.556 . . . . 1.44 109.959 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 96.3 mt -60.08 -50.97 78.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.826 -0.624 . . . . 1.17 111.42 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -65.65 -37.39 86.41 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.123 0.416 . . . . 2.05 112.123 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 33.2 ptt180 -69.63 -26.03 64.22 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 120.761 -0.376 . . . . 4.63 110.785 -179.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 49.3 m -68.36 -39.18 81.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.294 0.568 . . . . 0.93 109.684 178.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.8 mp -67.39 -41.93 84.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.735 -0.666 . . . . 2.04 110.123 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.06 -34.9 77.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.795 -0.638 . . . . 1.22 111.043 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -73.14 -25.08 60.69 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.825 0.345 . . . . 1.45 111.086 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.403 0 CA-C-N 116.513 -0.312 . . . . 1.28 110.992 179.769 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.579 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 48.8 mt-30 . . . . . 0 N--CA 1.458 -0.062 0 CA-C-O 120.875 0.369 . . . . 3.17 110.08 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.561 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 70.3 t80 -59.11 -48.97 79.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.73 -0.668 . . . . 1.44 110.508 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.0 -39.08 88.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.889 -0.596 . . . . 1.38 111.039 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -64.99 -32.49 74.24 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 115.889 -0.596 . . . . 1.95 111.197 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.579 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 27.6 mmmt -76.49 -40.72 49.45 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 121.065 -0.254 . . . . 1.78 110.589 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.15 -39.78 91.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.067 -0.515 . . . . 2.19 111.381 -179.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -76.11 -1.96 28.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.425 -0.352 . . . . 1.96 111.599 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.7 m -126.93 32.39 5.12 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.586 0.708 . . . . 2.11 110.155 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 14.6 mt -111.75 168.1 9.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.683 -0.69 . . . . 1.63 111.162 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.529 ' HG2' ' H ' ' A' ' 17' ' ' ASP . 11.1 tt0 -137.9 173.72 11.33 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.551 -0.907 . . . . 2.16 108.551 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.529 ' H ' ' HG2' ' A' ' 16' ' ' GLU . 4.6 p30 -79.78 16.43 1.14 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.768 0.318 . . . . 1.94 111.665 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.4 ' OG ' ' HB3' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -82.07 132.67 35.25 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.832 -0.433 . . . . 1.89 109.832 178.885 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.457 ' HG2' ' N ' ' A' ' 20' ' ' GLU . 16.5 pm0 -62.94 -39.21 93.93 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.019 0.377 . . . . 3.13 112.019 -178.33 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.457 ' N ' ' HG2' ' A' ' 19' ' ' GLN . 5.9 tp10 -71.31 -25.62 62.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.995 0.426 . . . . 2.99 110.152 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 66.8 m -71.21 -44.32 65.63 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.9 -0.778 . . . . 1.62 108.9 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.2 mm -65.29 -45.09 94.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 108.69 -0.856 . . . . 1.52 108.69 178.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.8 t -54.86 -43.81 73.42 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.208 -0.905 . . . . 1.63 110.884 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.8 t -58.45 -43.51 88.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 1.4 110.857 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.9 -45.15 59.78 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.266 -0.424 . . . . 1.14 110.989 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.403 ' HG ' ' CG ' ' A' ' 66' ' ' HIS . 34.4 m -59.8 -40.65 89.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.325 -0.398 . . . . 1.62 111.306 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.56 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 8.2 mptt -56.97 -43.97 82.15 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.085 0.469 . . . . 2.76 110.273 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 24.2 t90 -68.93 -36.68 78.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.674 -0.694 . . . . 1.14 110.454 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -66.85 -43.64 83.1 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.193 -0.458 . . . . 1.91 110.91 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.4 mt -60.3 -27.41 67.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.071 -0.513 . . . . 1.71 111.793 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 77.8 mt -68.37 -39.09 81.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.934 0.397 . . . . 2.2 111.109 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -95.28 56.77 1.92 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.454 0.645 . . . . 1.53 110.716 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.407 ' HA ' ' CE2' ' A' ' 79' ' ' PHE . 36.5 p90 -64.51 -17.24 63.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.476 -0.784 . . . . 2.35 111.557 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 34' ' ' ARG . 9.3 ttp180 -79.9 -3.7 49.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.831 0.348 . . . . 4.54 111.229 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.45 22.18 12.23 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.073 0.463 . . . . 1.7 110.05 179.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.45 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.05 -51.75 68.39 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.253 -0.885 . . . . 1.06 112.274 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 24.1 Cg_endo -62.77 -33.06 77.58 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 121.721 1.614 . . . . 0.62 112.521 179.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -46.73 72.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.334 -0.394 . . . . 3.25 111.059 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.2 m -74.56 -25.72 19.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.684 -0.406 . . . . 1.12 110.728 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.05 -49.99 65.74 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.359 -0.382 . . . . 0.99 110.769 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 4.1 pt-20 -66.71 -35.94 81.31 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.328 -0.396 . . . . 1.4 110.258 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.561 ' SD ' ' HB3' ' A' ' 8' ' ' PHE . 16.3 ttm -65.18 -40.67 94.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.095 -0.502 . . . . 2.13 109.946 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 67.4 t90 -63.78 -48.03 78.53 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.793 -0.64 . . . . 0.47 109.645 178.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.8 ttpt -59.75 -46.89 87.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.785 -0.643 . . . . 1.71 110.396 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.549 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 0.8 OUTLIER -59.72 -47.14 86.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.989 -0.55 . . . . 1.96 110.526 179.798 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -61.37 -49.64 76.11 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.714 -0.675 . . . . 2.37 111.549 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 89.0 mmm -63.4 -28.38 69.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.376 -0.374 . . . . 1.15 111.937 -179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 73.6 mt -97.89 22.48 9.2 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 111.648 0.24 . . . . 1.39 111.648 -179.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.549 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 11.2 mtp180 -101.18 139.22 20.28 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.722 0.296 . . . . 3.14 110.689 179.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.26 -1.81 11.47 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 123.128 2.552 . . . . 1.07 112.789 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.15 17.34 21.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.998 -0.546 . . . . 1.64 110.751 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 24.2 t -123.32 114.8 43.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.082 -0.508 . . . . 1.17 111.15 -179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -67.23 159.65 28.66 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.93 -0.577 . . . . 2.2 110.02 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.35 -37.9 73.3 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.54 0.57 . . . . 1.52 112.54 -178.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -40.94 95.53 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.604 0.24 . . . . 4.09 110.613 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.1 mtm-85 -70.56 -36.46 73.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.407 -0.36 . . . . 3.61 110.465 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -65.37 -37.37 86.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.419 0.628 . . . . 1.15 109.369 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 19.2 tp -64.08 -36.81 85.23 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.585 -0.734 . . . . 1.87 109.595 178.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.3 mp -68.21 -39.37 82.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.41 -0.814 . . . . 2.11 109.819 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.29 -32.95 85.9 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 111.452 -0.659 . . . . 0.4 111.452 179.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.24 -40.19 86.29 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.431 -0.581 . . . . 1.88 109.431 178.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -60.35 -44.57 95.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.555 -0.748 . . . . 2.18 110.264 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 12.4 tp -63.25 -43.9 96.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.004 -0.544 . . . . 2.19 110.701 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.448 ' O ' HG23 ' A' ' 68' ' ' VAL . 12.7 tmm? -59.86 -49.62 76.98 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.006 -0.543 . . . . 1.17 110.392 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -59.25 -42.69 91.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.062 0.458 . . . . 2.22 110.325 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.403 ' CG ' ' HG ' ' A' ' 26' ' ' SER . 40.5 t-80 -61.99 -53.82 50.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.708 -0.678 . . . . 2.15 112.1 -179.295 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 35.8 m -62.05 -37.45 78.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 N-CA-C 112.89 0.7 . . . . 2.07 112.89 -177.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 64' ' ' MET . 33.0 m -79.06 -27.04 13.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 120.368 -0.533 . . . . 1.18 111.44 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -72.12 -49.06 39.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.995 0.426 . . . . 2.59 109.854 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -71.44 -20.21 62.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.805 -0.634 . . . . 2.55 110.614 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.1 -21.54 66.57 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.052 -0.522 . . . . 1.16 111.201 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.87 -31.47 69.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.775 0.322 . . . . 2.55 110.298 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -75.89 -40.78 29.8 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.632 -0.794 . . . . 0.66 111.232 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -79.52 -12.63 59.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.71 -0.245 . . . . 1.91 110.555 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 41.1 mttp 65.27 34.07 8.67 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 123.658 0.599 . . . . 3.18 110.93 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 27.0 mm -93.06 85.55 2.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.043 -0.526 . . . . 1.2 110.264 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 19.5 pt -69.95 -24.89 26.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.761 -0.654 . . . . 1.4 110.999 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.83 -35.47 74.81 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.104 -0.498 . . . . 2.37 110.713 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.407 ' CE2' ' HA ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -69.75 -49.13 56.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.249 -0.432 . . . . 2.23 110.333 179.633 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -63.31 -35.64 81.04 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.482 -0.781 . . . . 1.45 111.027 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.534 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 17.3 t70 -66.53 -51.11 60.19 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.081 0.467 . . . . 1.32 110.544 179.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.8 m -63.24 -42.28 99.2 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.447 -0.797 . . . . 1.18 111.84 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -77.87 -35.09 51.32 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.965 -0.294 . . . . 2.13 111.334 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.84 -40.89 98.87 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 121.393 -0.432 . . . . 0.34 113.845 -178.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.534 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 14.3 ptpt -65.98 -24.27 66.75 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 117.148 0.474 . . . . 1.9 112.234 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.2 m -105.1 -15.13 8.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 C-N-CA 120.914 -0.314 . . . . 1.04 111.022 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.73 -49.99 74.21 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.193 -0.458 . . . . 1.09 111.215 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.1 -41.61 75.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.496 . . . . 1.13 111.04 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.537 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 4.8 tp10 -62.62 -60.07 4.03 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.753 -0.658 . . . . 1.56 110.449 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.51 ' O ' HG12 ' A' ' 94' ' ' ILE . 72.6 t -56.45 -49.22 78.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.728 -0.669 . . . . 1.15 111.835 -178.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 54.4 mt -58.63 -38.32 77.82 Favored 'General case' 0 C--N 1.331 -0.22 0 O-C-N 123.146 0.279 . . . . 2.15 111.532 -179.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -70.6 -28.89 70.3 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.703 -0.761 . . . . 0.41 112.72 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.537 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 23.9 mmm-85 -83.44 -49.62 9.12 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 122.857 -0.202 . . . . 3.95 111.3 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.51 HG12 ' O ' ' A' ' 90' ' ' VAL . 20.8 pt -66.09 -20.37 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 N-CA-C 111.988 0.366 . . . . 1.22 111.988 -178.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -63.1 -28.16 69.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.333 0.587 . . . . 1.06 109.937 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -88.67 -13.21 40.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.724 -0.671 . . . . 1.57 110.738 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -97.1 -38.03 9.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.968 -0.56 . . . . 1.33 111.147 -179.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 14.0 m-30 -72.8 125.94 90.9 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 116.424 -0.353 . . . . 2.29 110.932 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.48 177.44 3.96 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.554 2.169 . . . . 1.47 112.029 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 13.8 ptt-85 -52.61 -36.05 55.57 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 112.862 0.69 . . . . 5.56 112.862 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . 0.432 ' HA ' ' HE2' ' A' ' 104' ' ' LYS . 1.3 m-20 -76.66 -25.28 53.55 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.741 0.645 . . . . 2.58 112.741 -178.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 14.9 mt -93.37 -31.18 14.75 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.868 -0.333 . . . . 1.4 110.972 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . 0.449 ' HA ' HD22 ' A' ' 106' ' ' LEU . 32.0 pttt -63.14 -31.61 72.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.456 -0.338 . . . . 2.83 111.134 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.432 ' HE2' ' HA ' ' A' ' 101' ' ' ASP . 51.3 mtmt -64.43 -37.92 89.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.053 0.454 . . . . 2.98 110.302 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.6 mttm -70.46 -40.97 73.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.843 -0.617 . . . . 2.89 109.852 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.449 HD22 ' HA ' ' A' ' 103' ' ' LYS . 0.1 OUTLIER -65.31 -35.91 82.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.955 -0.566 . . . . 1.81 109.728 178.877 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 65.1 m -62.89 -37.18 85.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.185 -0.461 . . . . 1.53 110.362 178.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 39.1 mtt180 -65.05 -36.52 84.6 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 109.847 -0.427 . . . . 4.16 109.847 179.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 49.1 t -67.37 -49.76 68.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.991 -0.55 . . . . 1.81 110.013 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 71.0 t -59.16 -37.1 66.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.208 0.527 . . . . 1.68 110.043 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -60.12 -59.61 5.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.342 -0.844 . . . . 2.24 111.06 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.7 tt -61.41 -34.31 60.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 N-CA-C 111.847 0.314 . . . . 1.8 111.847 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 73.6 mt -63.09 -49.98 72.32 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.931 0.345 . . . . 1.98 111.931 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.6 ptpt -82.56 -29.1 30.54 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.07 0.396 . . . . 2.17 112.07 -178.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -67.18 -41.9 85.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.715 0.293 . . . . 2.2 110.908 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -90.8 3.69 53.72 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.529 -0.305 . . . . 3.8 110.523 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 51.27 59.28 4.71 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.618 -0.719 . . . . 2.23 111.059 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 46.6 mm -73.89 -38.75 50.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.677 -0.692 . . . . 1.26 109.888 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -107.15 169.52 8.51 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.691 -0.686 . . . . 2.11 109.569 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.52 157.67 19.83 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 123.27 0.356 . . . . 1.55 110.517 179.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.25 -35.39 69.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.506 -0.315 . . . . 3.34 111.429 -178.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -68.11 -37.01 80.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.826 0.346 . . . . 3.37 110.764 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 58.5 t -70.46 -47.11 67.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.326 -0.397 . . . . 1.92 110.88 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 27.5 m -66.21 -24.31 33.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.982 0.42 . . . . 1.92 110.43 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.27 -20.57 47.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.879 -0.601 . . . . 2.18 110.241 179.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.481 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 20.3 t0 -83.87 -39.57 19.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.421 0.629 . . . . 1.44 109.721 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 63.1 mt -61.93 -46.5 96.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.701 -0.681 . . . . 1.17 110.91 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -66.36 -37.85 86.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.431 -0.35 . . . . 2.05 111.764 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.481 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 30.5 ptt180 -68.93 -39.57 79.53 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.84 -0.344 . . . . 4.63 110.741 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 48.7 m -70.24 -35.37 73.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.948 0.404 . . . . 0.93 110.794 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.9 -45.6 81.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.181 -0.463 . . . . 2.04 110.266 179.269 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.83 -39.15 69.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.726 -0.67 . . . . 1.22 111.535 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.27 -31.68 72.3 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.82 0.343 . . . . 1.45 111.498 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.098 -0.501 . . . . 1.28 111.589 -179.869 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 . . . . . 0 C--O 1.226 -0.151 0 CA-C-O 121.074 0.464 . . . . 3.17 110.874 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -91.37 -38.05 12.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.961 -0.563 . . . . 1.44 110.634 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.84 -44.26 94.16 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.731 -0.668 . . . . 1.38 112.487 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 4.5 t -68.33 -26.85 65.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.645 0.259 . . . . 1.95 111.236 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.501 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 29.8 mmmt -68.8 -36.15 77.9 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 120.805 0.336 . . . . 1.78 110.146 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 42.9 mt -67.54 -34.84 77.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.913 -0.585 . . . . 2.19 110.669 179.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 -70.12 -31.28 68.74 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.75 -0.659 . . . . 1.96 111.621 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.5 t -104.09 16.52 26.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.751 0.31 . . . . 2.11 111.81 -179.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 8.1 mt -73.73 176.4 6.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.101 0.477 . . . . 1.63 111.342 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.467 ' HG2' ' H ' ' A' ' 17' ' ' ASP . 5.6 tt0 -146.25 168.8 20.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.715 -0.675 . . . . 2.16 109.552 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.467 ' H ' ' HG2' ' A' ' 16' ' ' GLU . 5.2 p-10 -84.16 10.26 10.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.193 0.521 . . . . 1.94 110.089 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.453 ' O ' HG12 ' A' ' 22' ' ' ILE . 1.4 t -77.16 129.04 35.45 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.509 -0.769 . . . . 1.89 110.53 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -65.34 -33.2 75.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.494 0.664 . . . . 3.13 109.841 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -66.93 -46.43 74.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.986 -1.006 . . . . 2.99 111.096 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.422 ' HG ' ' CB ' ' A' ' 18' ' ' SER . 42.6 p -69.14 -39.48 78.83 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 121.071 -0.252 . . . . 1.62 111.46 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 18' ' ' SER . 39.7 mm -59.25 -45.24 93.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 120.765 0.317 . . . . 1.52 110.383 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 t -63.97 -29.91 71.03 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.175 -0.466 . . . . 1.63 110.531 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.0 m -68.62 -31.12 70.06 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.134 -0.485 . . . . 1.4 110.399 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.15 -44.88 28.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.921 -0.582 . . . . 1.14 110.681 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.7 p -64.96 -33.18 75.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.313 -0.403 . . . . 1.62 110.673 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.436 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -63.1 -33.15 74.83 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.256 -0.429 . . . . 2.76 110.734 179.374 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 17.4 t90 -79.87 -34.51 39.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.05 0.452 . . . . 1.14 109.946 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.1 mp -63.78 -41.23 97.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.989 -0.55 . . . . 1.91 110.923 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.59 -21.08 66.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.459 -0.337 . . . . 1.71 111.803 -179.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 79.1 mt -76.24 -32.23 58.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.837 0.351 . . . . 2.2 110.634 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -105.19 59.8 0.68 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.671 0.748 . . . . 1.53 109.791 179.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 28.1 p90 -60.85 -21.34 63.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.137 -0.938 . . . . 2.35 111.831 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 66.7 mtt180 -77.86 -12.35 59.97 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.075 0.464 . . . . 4.54 110.506 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.34 7.09 44.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.044 -0.525 . . . . 1.7 110.492 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.464 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -51.31 -52.57 58.02 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-N 115.518 -0.765 . . . . 1.06 112.316 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.464 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 21.7 Cg_endo -61.76 -31.71 85.93 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 121.853 1.702 . . . . 0.62 112.227 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' A' ' 42' ' ' MET . 47.3 mtpt -73.17 -51.08 19.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.942 -0.572 . . . . 3.25 111.174 -179.205 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 28.0 m -67.96 -27.07 36.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 120.998 -0.281 . . . . 1.12 110.931 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.32 -51.44 60.61 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.934 0.397 . . . . 0.99 110.527 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -70.06 -34.94 73.84 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.382 -0.372 . . . . 1.4 110.12 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.418 ' HB2' ' O ' ' A' ' 38' ' ' LYS . 14.4 ttm -61.96 -42.22 98.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.972 -0.558 . . . . 2.13 109.655 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 53.4 t90 -63.35 -49.95 71.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.228 -0.896 . . . . 0.47 110.191 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.9 tmtt? -58.16 -46.51 85.58 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.764 -0.653 . . . . 1.71 110.949 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.503 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 64.7 mm-40 -61.54 -47.35 85.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.029 -0.532 . . . . 1.96 111.7 -179.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -65.39 -45.7 82.95 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.177 -0.465 . . . . 2.37 111.152 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 72.9 mmm -63.4 -28.39 69.95 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.196 0.443 . . . . 1.15 112.196 -178.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 15.4 mt -97.26 14.99 24.1 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 111.927 0.343 . . . . 1.39 111.927 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.503 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 79.5 mtt180 -89.29 139.76 28.56 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 110.301 -0.259 . . . . 3.14 110.301 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.08 -18.32 27.49 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.942 2.428 . . . . 1.07 112.685 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.23 -7.15 56.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.211 0.529 . . . . 1.64 111.252 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.2 t -97.81 125.27 51.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.034 -0.53 . . . . 1.17 110.853 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -74.49 152.71 39.36 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.695 -0.684 . . . . 2.2 110.015 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -34.64 64.07 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.12 0.415 . . . . 1.52 112.12 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.59 -34.47 78.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.845 0.355 . . . . 4.09 110.671 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.4 mmt-85 -74.4 -33.47 63.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.381 -0.372 . . . . 3.61 110.299 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 57.4 mttt -65.44 -32.28 73.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.08 -0.509 . . . . 1.15 109.956 179.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 75.3 mt -63.94 -43.13 96.8 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.397 -0.594 . . . . 1.87 109.397 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.5 mp -64.78 -41.53 95.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.395 -0.82 . . . . 2.11 110.068 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.31 -36.6 93.41 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.884 -0.674 . . . . 0.4 111.458 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 49.1 tp -69.79 -36.14 75.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.998 0.428 . . . . 1.88 110.065 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 9.8 m-30 -61.59 -40.11 93.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.706 -0.679 . . . . 2.18 110.648 179.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.75 -40.78 98.32 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.917 -0.583 . . . . 2.19 110.539 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.437 ' O ' HG21 ' A' ' 68' ' ' VAL . 13.4 tmm? -61.5 -51.39 68.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.357 -0.383 . . . . 1.17 110.441 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.433 ' O ' ' HB2' ' A' ' 69' ' ' GLN . 13.5 t30 -58.92 -35.91 73.85 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.968 0.413 . . . . 2.22 111.086 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.451 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 1.9 t-80 -74.84 -50.42 17.14 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.302 -0.408 . . . . 2.15 111.804 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 9.9 p -60.18 -39.28 80.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 112.092 0.404 . . . . 2.07 112.092 -178.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.437 HG21 ' O ' ' A' ' 64' ' ' MET . 33.6 m -75.01 -24.18 17.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 120.769 -0.372 . . . . 1.18 111.03 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 65' ' ' ASN . 3.0 tp-100 -67.91 -49.53 61.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.111 0.481 . . . . 2.59 110.151 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 9.2 pt20 -82.89 -14.95 53.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.793 -0.64 . . . . 2.55 111.202 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.64 -38.67 91.79 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 120.994 0.426 . . . . 1.16 110.191 179.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -68.76 -25.65 64.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.66 -0.7 . . . . 2.55 110.383 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.19 -31.06 79.44 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 111.067 -0.813 . . . . 0.66 111.067 178.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -99.02 -3.19 35.42 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.205 -0.665 . . . . 1.91 109.205 178.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.0 mttp 57.84 40.09 26.32 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 114.696 -1.138 . . . . 3.18 112.05 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 24.3 mm -90.99 90.8 3.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.585 -0.524 . . . . 1.2 109.585 179.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 18.5 pt -66.85 -14.19 17.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.863 -0.608 . . . . 1.4 111.689 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -58.48 -44.16 89.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.876 0.369 . . . . 2.37 110.254 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -70.96 -37.33 72.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.129 -0.487 . . . . 2.23 110.444 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -62.12 -37.42 85.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.911 -0.586 . . . . 1.45 110.851 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -80.26 -46.81 15.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.535 -0.302 . . . . 1.32 110.677 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' SER . . . . . 0.517 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 66.1 m -57.65 -52.1 66.82 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.057 -0.52 . . . . 1.18 111.786 -179.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -82.44 -21.01 35.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.547 -0.297 . . . . 2.13 111.485 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -64.4 -51.3 53.67 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.861 -0.685 . . . . 0.34 113.491 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.517 ' HE2' ' HA ' ' A' ' 82' ' ' SER . 25.9 pttt -68.15 -12.77 61.49 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.776 0.658 . . . . 1.9 112.776 -178.343 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 33.1 m -109.35 -16.03 9.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 120.719 -0.392 . . . . 1.04 111.417 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.14 87.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.358 -0.383 . . . . 1.09 111.1 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.86 -38.82 83.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.056 -0.52 . . . . 1.13 110.95 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -63.84 -52.91 57.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.745 -0.662 . . . . 1.56 110.614 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.52 ' O ' HG12 ' A' ' 94' ' ' ILE . 99.6 t -65.38 -45.2 93.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.822 -0.627 . . . . 1.15 111.265 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -58.49 -45.09 89.43 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.732 0.301 . . . . 2.15 111.268 -179.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -68.17 -26.06 74.27 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.729 -0.748 . . . . 0.41 112.505 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 4.8 mmm-85 -85.54 -46.97 10.33 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.862 0.319 . . . . 3.95 111.862 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.52 HG12 ' O ' ' A' ' 90' ' ' VAL . 43.1 pt -65.84 -26.86 39.67 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 C-N-CA 121.119 -0.232 . . . . 1.22 111.371 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 60.7 t30 -62.27 -26.74 68.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.062 0.458 . . . . 1.06 110.493 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -81.67 -35.59 29.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.065 -0.516 . . . . 1.57 110.422 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -81.34 -30.04 33.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.834 -0.621 . . . . 1.33 111.396 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -81.37 118.54 72.7 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 116.043 -0.526 . . . . 2.29 111.613 -179.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -64.35 -177.41 0.5 Allowed 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.91 2.406 . . . . 1.47 111.582 178.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 67.7 mtm-85 -51.08 -49.48 60.56 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.114 0.483 . . . . 5.56 111.422 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.51 -39.23 79.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.42 -0.809 . . . . 2.58 112.899 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 32.4 mt -86.91 -34.0 19.53 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.098 0.777 . . . . 1.4 113.098 -177.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . 0.546 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 0.4 OUTLIER -68.2 -20.97 64.88 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.681 -0.408 . . . . 2.83 111.115 -179.407 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -70.15 -21.69 63.05 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.064 0.459 . . . . 2.98 109.906 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 42.7 mttm -77.91 -45.94 22.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.659 -0.701 . . . . 2.89 110.653 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 103' ' ' LYS . 4.0 pp -65.11 -24.69 67.5 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 110.148 -0.316 . . . . 1.81 110.148 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 60.3 m -60.95 -37.75 83.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.111 0.481 . . . . 1.53 110.152 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 28.0 ttm180 -72.95 -37.29 67.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.88 -0.6 . . . . 4.16 109.724 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 60.3 t -62.85 -49.43 83.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.711 -0.677 . . . . 1.81 110.411 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 93.3 t -59.48 -36.61 65.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.746 -0.661 . . . . 1.68 110.595 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -59.91 -54.28 48.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.165 -0.471 . . . . 2.24 110.467 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 55.8 mt -62.09 -40.14 86.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.94 -0.573 . . . . 1.8 110.879 -179.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.456 ' HA ' ' CG1' ' A' ' 118' ' ' ILE . 5.6 mp -63.82 -34.71 78.52 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.885 -0.598 . . . . 1.98 112.323 -179.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.6 ptmm? -90.27 -37.94 13.75 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.417 0.525 . . . . 2.17 112.417 -178.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -72.94 -36.03 67.11 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.347 0.499 . . . . 2.2 112.347 -178.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -95.05 5.62 51.37 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.947 -0.301 . . . . 3.8 111.298 -178.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 51.51 71.23 0.46 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.445 0.64 . . . . 2.23 110.629 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.456 ' CG1' ' HA ' ' A' ' 113' ' ' LEU . 30.3 mm -83.94 -42.8 17.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.77 -0.65 . . . . 1.26 110.288 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -115.07 177.94 4.47 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.075 -0.511 . . . . 2.11 110.051 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.2 t -68.7 159.89 31.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.375 -0.375 . . . . 1.55 110.464 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 45.4 mtmt -56.46 -41.53 76.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.872 -0.604 . . . . 3.34 111.573 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -61.89 -37.61 85.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.012 -0.54 . . . . 3.37 110.497 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.458 ' O ' HG13 ' A' ' 127' ' ' ILE . 68.1 t -70.95 -46.15 69.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.961 -0.563 . . . . 1.92 110.462 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.414 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 88.0 t -56.35 -46.78 81.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.153 -0.476 . . . . 1.92 110.62 179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -63.03 -36.29 83.08 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.816 -0.629 . . . . 2.18 110.844 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -67.9 -40.06 83.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 1.44 110.305 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . 0.458 HG13 ' O ' ' A' ' 123' ' ' VAL . 85.3 mt -63.72 -47.08 92.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.187 -0.46 . . . . 1.17 110.272 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' A' ' 124' ' ' VAL . 43.8 mt-10 -58.23 -50.87 72.04 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.867 -0.606 . . . . 2.05 111.286 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 12.0 ptm180 -64.81 -26.03 68.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.432 -0.349 . . . . 4.63 111.599 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 74.0 m -68.47 -37.42 80.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.074 0.464 . . . . 0.93 110.343 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 29.5 mt -76.43 -41.87 46.07 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.856 -0.611 . . . . 2.04 110.595 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.03 99.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.853 -0.612 . . . . 1.22 111.8 -179.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.47 -30.44 71.56 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.256 -0.429 . . . . 1.45 111.427 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 1.28 110.887 -179.993 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 120.862 0.363 . . . . 5.77 110.596 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -93.52 119.87 33.1 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.708 -0.478 . . . . 6.18 109.708 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.429 ' HB2' ' HB3' ' A' ' 7' ' ' GLN . 16.1 m -73.25 126.31 29.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.259 -0.428 . . . . 3.04 110.773 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 m -67.01 133.12 49.29 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.177 -0.465 . . . . 3.56 111.069 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.8 mp0 54.76 34.57 22.1 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.903 -0.59 . . . . 2.9 111.592 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.431 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 14.0 pt20 -58.82 -34.94 72.1 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.849 0.314 . . . . 3.17 111.849 -179.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -82.87 -43.49 16.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.132 0.492 . . . . 1.44 110.083 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.77 -40.27 87.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.499 -0.773 . . . . 1.38 112.396 -179.244 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 19.4 m -65.13 -37.72 88.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.692 0.282 . . . . 1.95 111.632 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.495 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 16.8 mmmt -69.36 -33.88 73.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.698 -0.228 . . . . 1.78 111.124 -179.286 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.3 mt -66.58 -23.86 66.26 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.947 0.404 . . . . 2.19 111.277 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -98.05 2.98 49.34 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.235 -0.439 . . . . 1.96 111.841 -179.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.4 p -120.37 15.39 12.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.026 0.441 . . . . 2.11 111.059 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 69.7 mt -97.05 165.73 11.93 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.371 0.605 . . . . 1.63 111.674 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.439 ' HG2' ' N ' ' A' ' 17' ' ' ASP . 35.3 tt0 -134.09 166.94 21.57 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.198 -1.038 . . . . 2.16 108.198 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.439 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 6.0 p-10 -72.77 5.83 2.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.815 0.34 . . . . 1.94 111.293 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.409 ' HB2' ' HG2' ' B' ' 206' ' ' PRO . 7.9 t -84.26 139.67 32.18 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.474 -0.33 . . . . 1.89 110.422 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -62.0 -33.02 73.56 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.166 -0.47 . . . . 3.13 110.306 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.02 -28.45 69.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.791 -0.641 . . . . 2.99 110.165 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 t -81.26 -53.47 6.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.924 -0.58 . . . . 1.62 110.606 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.0 mm -56.66 -43.34 78.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.389 -0.368 . . . . 1.52 110.86 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.6 t -60.88 -35.19 75.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 1.63 111.113 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.6 m -64.05 -32.98 74.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.267 -0.424 . . . . 1.4 111.934 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -90.84 -35.73 14.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.87 0.367 . . . . 1.14 110.869 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 22.4 t -62.74 -49.34 75.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.114 -0.493 . . . . 1.62 110.664 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.41 -22.6 67.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 2.76 110.638 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.488 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 62.1 t90 -78.91 -32.36 45.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.924 -0.58 . . . . 1.14 109.865 179.113 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 11.5 tp -81.88 -36.83 27.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.917 -0.583 . . . . 1.91 110.883 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 79.2 mt -61.47 -22.55 65.17 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.609 0.596 . . . . 1.71 112.609 -179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 4.3 pp -85.79 -9.37 57.17 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.646 -0.422 . . . . 2.2 111.187 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -123.21 56.45 1.18 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.605 0.717 . . . . 1.53 110.563 -179.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 27.0 p90 -64.01 -7.12 7.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.597 -0.729 . . . . 2.35 112.371 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -65.04 -34.26 78.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.027 0.441 . . . . 4.54 110.662 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -96.74 23.7 6.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.757 -0.656 . . . . 1.7 111.501 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -52.37 -54.51 41.21 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 112.601 0.593 . . . . 1.06 112.601 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.34 -29.11 46.4 Favored 'Trans proline' 0 C--N 1.355 0.89 0 C-N-CA 121.563 1.509 . . . . 0.62 112.34 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -72.71 -46.14 55.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.931 -0.577 . . . . 3.25 111.226 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 35.8 m -71.74 -26.19 25.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.781 -0.368 . . . . 1.12 110.6 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.94 -47.8 67.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.111 -0.495 . . . . 0.99 111.194 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -69.85 -36.23 75.37 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.825 -0.35 . . . . 1.4 110.448 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.2 mtm -63.89 -42.64 97.41 Favored 'General case' 0 CA--C 1.522 -0.129 0 N-CA-C 109.754 -0.462 . . . . 2.13 109.754 178.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 73.9 t90 -61.09 -47.09 87.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.575 -0.739 . . . . 0.47 109.463 178.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.456 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 37.3 ttpt -59.23 -51.46 69.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.362 -0.835 . . . . 1.71 110.606 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -58.78 -43.71 90.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.013 -0.539 . . . . 1.96 111.589 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -60.41 -47.32 86.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.313 -0.403 . . . . 2.37 111.37 -179.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 55.5 mtp -72.0 -11.76 60.92 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.77 0.285 . . . . 1.15 111.77 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 67.3 mt -95.17 -8.61 35.82 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.755 0.312 . . . . 1.39 110.65 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -79.89 130.02 68.5 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.331 -0.395 . . . . 3.14 110.472 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.15 -8.95 24.86 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.937 2.425 . . . . 1.07 112.436 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.43 -17.88 50.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.293 0.568 . . . . 1.64 110.133 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 76.9 t -89.3 111.06 22.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 CA-C-N 115.394 -0.821 . . . . 1.17 110.41 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -69.17 163.1 25.64 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.915 -0.584 . . . . 2.2 110.898 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.4 -34.98 59.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 1.52 111.878 -179.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 40.2 mmm-85 -58.45 -48.13 81.75 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.173 0.511 . . . . 4.09 110.49 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 36.7 mmt-85 -71.58 -35.73 70.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.789 -0.641 . . . . 3.61 110.761 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.3 mttt -61.72 -48.32 81.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.818 0.342 . . . . 1.15 110.372 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 24.2 tp -63.74 -37.03 85.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.149 -0.478 . . . . 1.87 110.409 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -64.44 -45.18 88.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.983 -0.553 . . . . 2.11 110.568 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.5 -31.01 77.48 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.912 -0.661 . . . . 0.4 112.015 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 43.4 tp -64.47 -36.95 85.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.959 0.409 . . . . 1.88 110.51 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -63.4 -40.17 96.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.016 -0.538 . . . . 2.18 110.85 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 27.0 tp -62.99 -36.51 83.79 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.182 -0.463 . . . . 2.19 111.029 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.43 ' O ' HG21 ' A' ' 68' ' ' VAL . 14.3 tmm? -65.84 -46.6 77.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.271 -0.422 . . . . 1.17 110.296 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -59.34 -39.1 82.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.075 -0.512 . . . . 2.22 110.772 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -63.44 -56.83 13.07 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.625 -0.716 . . . . 2.15 111.849 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 27.8 m -62.71 -38.98 83.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 113.28 0.844 . . . . 2.07 113.28 -177.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.43 HG21 ' O ' ' A' ' 64' ' ' MET . 32.6 m -73.91 -28.43 24.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 120.447 -0.501 . . . . 1.18 111.718 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -78.51 -45.56 21.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.776 0.322 . . . . 2.59 110.468 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -71.58 -17.94 62.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.311 -0.404 . . . . 2.55 110.875 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.49 -22.98 67.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.204 -0.453 . . . . 1.16 111.097 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.4 mmtt -63.19 -36.59 84.14 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.279 -0.418 . . . . 2.55 110.589 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -80.23 -28.81 47.74 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.741 -0.743 . . . . 0.66 111.886 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -80.1 -22.26 42.37 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.795 0.331 . . . . 1.91 110.279 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm 65.73 29.3 10.76 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.449 -0.796 . . . . 3.18 111.111 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 33.1 mm -104.15 92.87 2.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.514 -0.767 . . . . 1.2 109.508 179.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 17.3 pt -70.3 -14.57 18.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.935 -0.575 . . . . 1.4 111.304 -179.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 17.6 mp0 -55.69 -39.06 70.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.37 -0.377 . . . . 2.37 110.81 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -69.23 -50.68 45.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.117 -0.492 . . . . 2.23 110.766 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -63.89 -34.61 78.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.729 -0.669 . . . . 1.45 111.44 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.476 ' O ' ' HG2' ' A' ' 85' ' ' LYS . 6.7 t70 -67.54 -50.79 56.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.973 0.416 . . . . 1.32 110.456 179.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.7 m -66.05 -44.64 83.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.795 -0.639 . . . . 1.18 111.981 -179.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -75.49 -27.18 58.7 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 121.04 -0.264 . . . . 2.13 111.534 -179.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.71 -44.51 89.34 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.807 -0.711 . . . . 0.34 113.261 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.476 ' HG2' ' O ' ' A' ' 81' ' ' ASP . 2.3 ptpp? -65.96 -27.4 68.12 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.05 0.389 . . . . 1.9 112.05 -179.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 35.3 m -93.8 -21.8 5.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 120.742 -0.383 . . . . 1.04 111.075 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.446 ' O ' ' HB2' ' A' ' 91' ' ' LEU . . . -62.84 -43.07 99.77 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.275 -0.42 . . . . 1.09 110.98 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.58 -35.42 70.37 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.117 0.484 . . . . 1.13 110.998 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.644 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 6.1 tp10 -76.28 -56.29 4.78 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.97 -0.559 . . . . 1.56 110.279 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 70.5 t -56.91 -46.75 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.236 -0.438 . . . . 1.15 112.052 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.446 ' HB2' ' O ' ' A' ' 87' ' ' ALA . 2.4 mm? -60.23 -39.76 87.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.685 0.278 . . . . 2.15 110.587 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -67.93 -27.88 73.56 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.666 -0.778 . . . . 0.41 112.248 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.644 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 11.8 mmt85 -80.48 -50.9 9.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.666 0.27 . . . . 3.95 111.014 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.407 ' HA ' ' CG ' ' A' ' 97' ' ' GLU . 41.8 pt -64.56 -31.88 55.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 111.808 0.299 . . . . 1.22 111.808 -178.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -68.8 -17.37 64.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.701 0.286 . . . . 1.06 111.385 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 11.5 pt20 -106.93 8.12 30.37 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 122.014 -0.429 . . . . 1.57 111.776 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 6.2 pt-20 -129.79 -30.5 2.04 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.711 0.291 . . . . 1.33 111.096 178.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -71.47 139.52 84.08 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.382 -0.372 . . . . 2.29 111.055 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.427 ' HD2' HD12 ' A' ' 102' ' ' LEU . 37.0 Cg_endo -66.9 177.09 3.79 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.92 2.413 . . . . 1.47 112.337 178.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.506 ' O ' ' HG2' ' A' ' 103' ' ' LYS . 17.1 mmm-85 -57.33 -44.3 84.13 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.476 0.547 . . . . 5.56 112.476 -178.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.23 -32.62 74.15 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.673 0.249 . . . . 2.58 111.673 -178.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.427 HD12 ' HD2' ' A' ' 99' ' ' PRO . 15.6 mt -83.46 -35.54 24.87 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.823 -0.351 . . . . 1.4 111.497 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' ' 100' ' ' ARG . 10.9 ptmm? -63.02 -33.17 74.86 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.915 0.388 . . . . 2.83 109.972 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 47.2 mttt -67.65 -39.6 84.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.058 -0.519 . . . . 2.98 110.645 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.455 ' O ' HG22 ' A' ' 109' ' ' VAL . 81.9 mttt -66.14 -42.77 88.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.786 -0.643 . . . . 2.89 110.679 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 103' ' ' LYS . 3.7 pp -72.51 -23.03 60.96 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.626 -0.429 . . . . 1.81 110.588 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 61.7 m -61.91 -45.08 95.26 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 116.53 -0.305 . . . . 1.53 110.537 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -73.52 -27.98 61.65 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.805 -0.358 . . . . 4.16 110.493 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.544 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 94.5 t -68.52 -47.22 78.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.335 -0.393 . . . . 1.81 110.209 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 9.3 p -75.69 -24.8 17.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 1.68 110.746 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -65.26 -48.4 73.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.283 -0.417 . . . . 2.24 110.479 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.433 HG23 ' O ' ' A' ' 109' ' ' VAL . 11.4 tt -63.61 -26.19 40.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.376 -0.375 . . . . 1.8 110.867 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 87.5 mt -67.59 -41.99 83.21 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.765 0.317 . . . . 1.98 111.003 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -84.49 -26.52 28.08 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.807 -0.357 . . . . 2.17 111.0 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -71.49 -35.36 70.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.833 0.349 . . . . 2.2 110.818 179.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 31.5 mmm180 -94.13 3.37 55.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.252 -0.431 . . . . 3.8 111.001 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 52.09 56.83 7.2 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.454 0.645 . . . . 2.23 110.433 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 44.5 mm -72.47 -46.45 55.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.457 -0.792 . . . . 1.26 111.116 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -105.55 170.46 7.88 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.265 -0.425 . . . . 2.11 110.994 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.16 147.09 53.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.958 -0.565 . . . . 1.55 110.302 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -57.24 -29.2 63.59 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.931 0.396 . . . . 3.34 111.343 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -59.56 -47.66 84.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.969 -0.559 . . . . 3.37 111.578 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.52 ' O ' HG13 ' A' ' 127' ' ' ILE . 10.8 p -84.86 -31.27 7.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.295 -0.411 . . . . 1.92 111.274 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 39.0 t -59.34 -43.1 89.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 120.913 0.387 . . . . 1.92 110.381 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -67.69 -20.25 65.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.804 -0.635 . . . . 2.18 111.045 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -83.35 -36.12 24.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.985 0.421 . . . . 1.44 110.266 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 123' ' ' VAL . 42.2 mt -68.04 -51.32 50.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.156 -0.474 . . . . 1.17 110.875 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.58 -38.41 84.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.37 -0.377 . . . . 2.05 111.84 -179.031 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 15.3 ptp180 -71.21 -33.85 70.3 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.738 -0.385 . . . . 4.63 110.65 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 67.8 m -65.16 -38.59 91.06 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.03 0.443 . . . . 0.93 110.225 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 127' ' ' ILE . 58.2 mt -65.74 -40.2 91.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.846 -0.616 . . . . 2.04 109.947 179.369 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.7 -33.85 66.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.784 -0.643 . . . . 1.22 111.103 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.47 -37.54 86.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.928 0.394 . . . . 1.45 111.126 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -71.2 -16.9 62.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.05 -0.523 . . . . 1.28 110.888 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 131' ' ' LEU . 76.2 mt -92.1 -1.08 57.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.219 -0.446 . . . . 4.46 110.554 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -82.43 4.83 22.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.06 -0.518 . . . . 6.64 110.721 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 35.9 m-70 . . . . . 0 C--O 1.246 0.891 0 CA-C-N 115.645 -0.707 . . . . 8.81 111.09 179.092 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 206' ' ' PRO . . . . . 0.409 ' HG2' ' HB2' ' A' ' 18' ' ' SER . 73.6 Cg_exo . . . . . 0 N--CA 1.484 0.915 0 N-CA-C 112.628 0.203 . . . . 7.93 112.628 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 41.1 m 72.61 123.75 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.776 0.798 . . . . 6.33 112.497 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . 0.548 ' CE2' ' HA ' ' B' ' 213' ' ' PRO . 44.2 t80 -110.49 128.3 55.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.571 -0.74 . . . . 4.66 110.897 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 209' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -50.4 -33.48 37.73 Favored 'Trans proline' 0 N--CA 1.477 0.523 0 C-N-CA 123.302 2.668 . . . . 4.88 114.37 -179.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 1.3 m -77.47 -15.12 59.49 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.803 0.335 . . . . 5.34 111.425 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 18.5 m -129.39 78.67 75.39 Favored Pre-proline 0 C--O 1.236 0.361 0 CA-C-O 121.072 0.463 . . . . 3.29 110.054 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 213' ' ' PRO . . . . . 0.548 ' HA ' ' CE2' ' B' ' 208' ' ' TYR . 1.9 Cg_endo -86.22 -34.6 0.15 Allowed 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 123.327 2.685 . . . . 4.56 113.582 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 3.6 m . . . . . 0 C--O 1.246 0.907 0 CA-C-O 118.407 -0.806 . . . . 6.05 110.371 -179.245 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.125 0 CA-C-O 120.777 0.322 . . . . 5.77 110.846 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -138.2 122.27 17.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.382 -0.372 . . . . 6.18 110.15 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.82 117.47 34.21 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.195 -0.457 . . . . 3.04 110.814 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.2 m -72.57 138.07 46.61 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.297 -0.411 . . . . 3.56 111.105 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 56.97 30.43 18.08 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.622 -0.717 . . . . 2.9 111.538 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -62.42 -31.19 71.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.036 0.446 . . . . 3.17 111.108 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -87.22 -40.36 14.62 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.102 -0.499 . . . . 1.44 110.059 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.39 -38.85 92.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.738 -0.665 . . . . 1.38 111.623 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.83 -29.78 69.79 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.327 -0.397 . . . . 1.95 110.83 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.474 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 62.4 mmtt -71.8 -42.91 66.5 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 120.973 0.416 . . . . 1.78 110.625 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.92 -23.53 67.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.832 -0.622 . . . . 2.19 111.395 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -95.21 5.04 52.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.163 -0.471 . . . . 1.96 112.028 -178.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 p -130.61 20.47 5.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 2.11 111.253 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 52.0 mt -102.87 133.17 48.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.865 0.364 . . . . 1.63 111.577 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -100.32 173.69 6.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.601 -0.727 . . . . 2.16 109.359 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -80.83 35.57 0.37 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.408 0.623 . . . . 1.94 110.896 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.466 ' HB3' ' OG ' ' A' ' 21' ' ' SER . 4.0 t -107.26 136.95 46.2 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.102 -0.499 . . . . 1.89 109.735 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.465 ' OE1' ' HA ' ' B' ' 208' ' ' TYR . 0.0 OUTLIER -57.87 -44.0 86.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.935 -0.575 . . . . 3.13 111.289 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -62.97 -39.47 94.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.688 0.28 . . . . 2.99 111.432 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.466 ' OG ' ' HB3' ' A' ' 18' ' ' SER . 4.7 m -62.43 -50.56 71.01 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.356 -0.384 . . . . 1.62 110.387 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.9 mm -63.42 -38.43 82.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.261 -0.427 . . . . 1.52 109.983 179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 47.0 t -60.31 -39.34 86.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.936 -0.574 . . . . 1.63 110.539 179.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.4 m -61.09 -45.42 94.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 1.4 110.752 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.12 -34.29 66.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.397 -0.365 . . . . 1.14 110.827 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 44.0 t -62.7 -50.75 69.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.972 -0.558 . . . . 1.62 110.373 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -59.12 -37.12 76.46 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.133 0.492 . . . . 2.76 110.495 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.447 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 9.3 t90 -66.39 -39.13 88.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.379 -0.828 . . . . 1.14 110.724 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.7 tp -76.05 -35.51 59.41 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.406 -0.361 . . . . 1.91 111.015 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 78.4 mt -60.18 -32.02 70.68 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.179 -0.464 . . . . 1.71 112.248 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 2.8 pp -78.62 -26.66 45.33 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.793 -0.363 . . . . 2.2 111.21 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -98.1 48.74 1.0 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.627 0.727 . . . . 1.53 110.669 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.6 p90 -70.9 -4.22 23.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.462 -0.79 . . . . 2.35 111.467 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -70.54 -30.09 66.73 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.168 -0.679 . . . . 4.54 109.168 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -107.94 31.87 5.18 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.202 -0.908 . . . . 1.7 110.091 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.453 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -51.57 -51.6 68.12 Favored Pre-proline 0 CA--C 1.537 0.452 0 CA-C-N 115.653 -0.703 . . . . 1.06 112.097 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.453 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 32.8 Cg_endo -64.42 -31.63 61.55 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 121.582 1.521 . . . . 0.62 111.822 179.212 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.5 -47.74 69.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.866 -0.606 . . . . 3.25 111.247 -179.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.2 m -71.97 -27.51 27.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 C-N-CA 120.705 -0.398 . . . . 1.12 110.322 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.13 -47.27 62.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.166 -0.47 . . . . 0.99 110.426 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -68.66 -35.91 77.87 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.226 -0.443 . . . . 1.4 109.992 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 14.7 ttm -64.26 -42.85 96.28 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.06 -0.518 . . . . 2.13 110.119 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 61.9 t90 -60.14 -52.08 66.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.446 -0.797 . . . . 0.47 110.674 179.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.0 ttpt -61.03 -50.22 74.23 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.633 -0.712 . . . . 1.71 111.629 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -61.46 -33.66 74.12 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.307 -0.406 . . . . 1.96 112.045 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -73.9 -44.51 55.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.628 0.251 . . . . 2.37 111.004 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 62.6 mtp -70.48 -13.46 62.13 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.002 0.371 . . . . 1.15 112.002 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 49.9 mt -92.93 2.15 56.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.943 0.401 . . . . 1.39 110.609 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 59.2 mtp180 -88.0 136.5 32.21 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.105 -0.498 . . . . 3.14 110.443 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -68.98 -12.61 34.78 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.793 2.328 . . . . 1.07 112.337 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.44 -6.35 56.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.791 -0.641 . . . . 1.64 111.191 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 42.3 t -100.38 118.53 47.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.94 0.4 . . . . 1.17 110.798 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -74.68 158.45 33.57 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.799 -0.637 . . . . 2.2 110.223 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -33.23 62.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.403 -0.362 . . . . 1.52 111.781 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.0 mmm-85 -59.48 -44.74 92.98 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.142 -0.481 . . . . 4.09 110.939 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 12.4 mmt180 -75.84 -30.35 58.92 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.436 -0.347 . . . . 3.61 110.88 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -64.16 -41.98 96.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.03 0.443 . . . . 1.15 109.888 179.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 25.6 tp -66.41 -40.57 89.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.832 -0.622 . . . . 1.87 110.216 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -64.53 -41.83 96.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.051 -0.522 . . . . 2.11 110.388 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.19 -36.68 93.17 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.791 -0.719 . . . . 0.4 111.619 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 30.6 tp -63.8 -35.9 82.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.937 0.399 . . . . 1.88 110.122 178.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -65.09 -41.21 95.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.862 -0.608 . . . . 2.18 110.773 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 23.9 tp -64.94 -42.47 94.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.262 -0.426 . . . . 2.19 110.495 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 14.1 tmm? -61.52 -45.64 93.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.033 -0.53 . . . . 1.17 110.154 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -61.36 -36.32 79.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.83 -0.623 . . . . 2.22 111.089 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.556 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 4.3 t-80 -67.05 -56.88 8.16 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.744 -0.662 . . . . 2.15 111.456 -179.442 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 35.0 m -59.74 -39.29 79.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.218 0.821 . . . . 2.07 113.218 -177.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 34.7 m -71.12 -27.31 29.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 120.466 -0.494 . . . . 1.18 112.049 -178.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 62.7 mt-30 -73.68 -46.44 46.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.942 0.401 . . . . 2.59 110.131 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.556 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 37.5 mm-40 -74.58 -21.33 59.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.863 -0.608 . . . . 2.55 110.934 -179.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.58 -35.01 71.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.304 -0.407 . . . . 1.16 111.1 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -74.68 -20.81 59.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.86 0.362 . . . . 2.55 110.634 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -73.77 -32.54 59.05 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.698 -0.763 . . . . 0.66 111.241 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -97.69 -0.76 44.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.186 0.517 . . . . 1.91 109.87 179.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.8 mmmm 63.19 40.68 8.63 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.12 -0.945 . . . . 3.18 111.252 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.3 mm -100.25 86.28 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.091 -0.504 . . . . 1.2 109.783 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 25.2 pt -68.78 -18.6 23.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.847 -0.615 . . . . 1.4 111.489 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -59.47 -41.49 89.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.09 -0.505 . . . . 2.37 110.834 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -66.68 -50.68 62.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.852 -0.613 . . . . 2.23 111.188 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -62.06 -34.47 76.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.674 -0.694 . . . . 1.45 111.885 -178.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.485 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 13.8 t70 -71.26 -53.68 13.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.706 0.288 . . . . 1.32 110.359 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.9 m -59.28 -44.09 92.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.882 -0.599 . . . . 1.18 112.04 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -77.29 -35.82 54.76 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.771 0.285 . . . . 2.13 111.771 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.85 -41.21 97.59 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 121.178 -0.534 . . . . 0.34 114.039 -178.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.485 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 12.7 ptpt -65.71 -31.12 71.94 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.324 0.49 . . . . 1.9 112.324 -178.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.3 m -95.83 -19.38 6.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.64 -0.424 . . . . 1.04 111.241 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.68 -42.14 99.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.394 -0.367 . . . . 1.09 111.242 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.29 -41.71 80.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.439 . . . . 1.13 110.985 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.615 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 6.3 tp10 -67.0 -54.04 25.57 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.902 -0.59 . . . . 1.56 110.493 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 96.0 t -59.3 -45.65 93.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 1.15 111.607 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -56.78 -44.16 81.58 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.538 -0.301 . . . . 2.15 111.293 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -66.97 -37.19 91.97 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.454 -0.879 . . . . 0.41 112.424 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.615 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 9.8 mmt180 -68.17 -48.4 65.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.696 0.284 . . . . 3.95 110.958 -179.652 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.488 ' HA ' ' HG2' ' A' ' 97' ' ' GLU . 45.2 pt -70.08 -23.88 25.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.079 0.466 . . . . 1.22 111.043 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -65.79 -24.67 66.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.975 -0.557 . . . . 1.06 110.832 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.43 ' HB3' ' HB2' ' A' ' 134' ' ' ALA . 9.6 pt20 -110.63 1.25 17.9 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.55 0.574 . . . . 1.57 112.55 -178.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.488 ' HG2' ' HA ' ' A' ' 94' ' ' ILE . 1.5 pt-20 -117.69 -20.05 9.08 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.864 -0.334 . . . . 1.33 111.665 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -80.87 145.77 58.18 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 120.799 0.333 . . . . 2.29 111.279 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -66.26 171.78 9.83 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 123.046 2.498 . . . . 1.47 112.164 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -56.99 -42.66 80.65 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.565 0.58 . . . . 5.56 112.565 -178.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.21 -46.79 76.02 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 121.133 -0.227 . . . . 2.58 111.299 -178.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 36.7 mt -71.81 -29.69 64.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.827 0.346 . . . . 1.4 110.67 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . 0.42 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 0.0 OUTLIER -56.02 -50.89 69.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.773 -0.648 . . . . 2.83 110.574 179.53 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 57.1 tttt -66.04 -36.07 82.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.265 -0.425 . . . . 2.98 110.659 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -63.58 -44.06 95.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.148 -0.478 . . . . 2.89 110.913 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.48 ' O ' HG12 ' A' ' 109' ' ' VAL . 1.7 pp -74.54 -27.86 60.7 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.974 -0.291 . . . . 1.81 110.693 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 52.4 m -67.47 -41.05 85.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.515 -0.312 . . . . 1.53 111.242 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.461 ' O ' HG13 ' A' ' 112' ' ' ILE . 16.3 ptt180 -76.57 -31.75 57.74 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.848 -0.341 . . . . 4.16 110.708 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.48 HG12 ' O ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -69.02 -38.92 79.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-O 120.69 0.281 . . . . 1.81 110.637 -179.86 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 8.4 p -80.1 -21.13 11.83 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-O 121.257 0.551 . . . . 1.68 110.066 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -68.05 -41.6 81.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.743 -0.662 . . . . 2.24 109.625 179.397 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 108' ' ' ARG . 67.1 mt -62.64 -36.23 74.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.851 -0.613 . . . . 1.8 110.047 179.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 87.7 mt -61.84 -49.34 76.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 1.98 111.245 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -75.63 -28.04 58.65 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 121.008 -0.277 . . . . 2.17 111.59 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.438 ' HA ' ' OE1' ' A' ' 115' ' ' GLU . 2.6 mm-40 -73.71 -39.2 64.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.711 0.291 . . . . 2.2 111.064 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -83.79 -0.6 51.71 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.803 0.335 . . . . 3.8 110.367 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.89 48.42 8.92 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.435 -0.802 . . . . 2.23 110.808 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 42.9 mm -70.42 -46.14 72.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.75 -0.659 . . . . 1.26 109.979 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -101.84 164.71 11.58 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.811 -0.631 . . . . 2.11 110.19 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.6 t -68.77 145.82 53.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.211 -0.449 . . . . 1.55 110.162 179.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -59.03 -25.94 64.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.487 -0.324 . . . . 3.34 110.778 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -62.39 -38.56 90.08 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.074 -0.512 . . . . 3.37 111.09 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.465 ' O ' HG13 ' A' ' 127' ' ' ILE . 12.9 p -90.27 -31.48 5.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.841 -0.344 . . . . 1.92 110.504 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.7 t -59.8 -38.33 75.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 120.984 0.421 . . . . 1.92 110.245 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -62.25 -26.53 68.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.809 -0.632 . . . . 2.18 110.77 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.511 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 38.7 t70 -87.28 -36.67 17.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.351 -0.386 . . . . 1.44 110.205 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . 0.516 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 77.2 mt -60.89 -50.51 80.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.226 -0.443 . . . . 1.17 110.723 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -63.73 -37.29 86.79 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.396 -0.365 . . . . 2.05 111.578 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.511 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 6.5 ptp180 -70.34 -32.47 70.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.621 -0.263 . . . . 4.63 110.852 -179.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 49.0 m -65.89 -40.2 91.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.885 0.374 . . . . 0.93 110.394 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 127' ' ' ILE . 23.8 mt -66.26 -44.41 83.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.988 -0.551 . . . . 2.04 110.245 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.91 -36.63 78.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.886 -0.597 . . . . 1.22 111.715 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -59.25 -46.18 89.19 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.963 0.357 . . . . 1.45 111.963 -179.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . 0.43 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . . . -68.3 -18.73 64.59 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.855 0.359 . . . . 1.28 111.468 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 131' ' ' LEU . 97.4 mt -87.43 -6.9 58.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.393 -0.367 . . . . 4.46 110.573 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -76.43 -22.28 54.85 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.256 -0.429 . . . . 6.64 110.052 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 . . . . . 0 C--O 1.248 0.993 0 CA-C-N 115.422 -0.808 . . . . 8.81 110.507 -179.993 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 206' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo . . . . . 0 N--CA 1.482 0.816 0 N-CA-C 112.462 0.139 . . . . 7.93 112.462 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 2.2 m 59.33 80.52 0.19 Allowed 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.152 0.501 . . . . 6.33 112.021 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . 0.465 ' HA ' ' OE1' ' A' ' 19' ' ' GLN . 66.8 t80 -62.77 129.76 41.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.46 -0.336 . . . . 4.66 110.524 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 209' ' ' SEP . . . . . 0.406 ' HA ' ' HD3' ' B' ' 210' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' B' ' 209' ' ' SEP . 31.4 Cg_exo -60.59 -27.89 85.64 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.907 2.405 . . . . 4.88 112.73 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.93 -4.95 58.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.185 0.517 . . . . 5.34 110.696 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 19.2 m -137.95 77.53 37.53 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.028 -0.533 . . . . 3.29 110.092 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 213' ' ' PRO . . . . . 0.462 ' HB2' ' NE2' ' A' ' 66' ' ' HIS . 87.5 Cg_endo -89.13 -7.15 5.25 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.723 2.282 . . . . 4.56 113.445 -179.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 66.2 m . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.542 -0.742 . . . . 6.05 110.463 -179.649 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 120.813 0.34 . . . . 5.77 110.763 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -80.76 140.41 35.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.415 -0.357 . . . . 6.18 110.551 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.9 m -66.87 111.57 3.83 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.223 -0.444 . . . . 3.04 110.685 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.5 m -92.97 160.17 15.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.232 -0.44 . . . . 3.56 110.491 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 54.62 38.76 30.49 Favored 'General case' 0 N--CA 1.464 0.229 0 O-C-N 123.655 0.597 . . . . 2.9 111.845 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -64.6 -34.78 79.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.321 -0.4 . . . . 3.17 110.617 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -64.13 -47.38 80.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.945 -0.57 . . . . 1.44 110.285 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -39.14 93.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.06 -0.518 . . . . 1.38 110.881 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 12.2 m -63.36 -35.89 81.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.964 -0.562 . . . . 1.95 110.59 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.491 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 65.4 mmtt -65.04 -41.86 94.82 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.046 -0.524 . . . . 1.78 110.247 179.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -62.0 -34.49 76.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.853 -0.612 . . . . 2.19 111.235 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -77.98 -5.67 52.0 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.992 -0.549 . . . . 1.96 111.695 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 p -123.83 18.56 9.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.815 0.34 . . . . 2.11 111.604 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 17.0 mt -95.16 169.11 10.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.087 0.47 . . . . 1.63 111.39 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -139.79 -174.27 3.86 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.72 -0.673 . . . . 2.16 109.215 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -91.5 12.1 21.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.779 0.323 . . . . 1.94 111.424 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.461 ' O ' HG12 ' A' ' 22' ' ' ILE . 0.1 OUTLIER -85.41 132.25 34.25 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.867 -0.419 . . . . 1.89 109.867 179.093 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.497 ' OE1' ' HA ' ' B' ' 208' ' ' TYR . 0.0 OUTLIER -62.13 -29.37 70.29 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.69 0.281 . . . . 3.13 110.749 -179.455 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 -67.55 -44.09 79.1 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.811 -0.44 . . . . 2.99 109.811 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.1 m -64.63 -41.24 96.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.929 -0.578 . . . . 1.62 109.922 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 18' ' ' SER . 38.3 mm -63.41 -49.0 84.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 N-CA-C 109.257 -0.645 . . . . 1.52 109.257 178.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.8 m -57.28 -35.8 70.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.127 -0.488 . . . . 1.63 111.001 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.5 t -59.82 -40.07 87.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.456 . . . . 1.4 111.077 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.5 -43.65 13.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.319 -0.401 . . . . 1.14 111.206 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.9 m -59.36 -41.31 88.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.255 -0.43 . . . . 1.62 111.624 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.518 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 21.2 ttpt -61.95 -35.25 77.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.755 0.312 . . . . 2.76 110.194 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.514 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 25.0 t90 -72.81 -40.61 65.7 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.47 -0.567 . . . . 1.14 109.47 179.265 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -62.95 -38.46 91.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.831 -0.622 . . . . 1.91 110.756 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 86.4 mt -63.75 -28.26 69.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.985 0.421 . . . . 1.71 110.537 179.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 68.9 mt -76.09 -27.63 57.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.945 -0.571 . . . . 2.2 109.546 178.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.514 ' HG2' ' O ' ' A' ' 28' ' ' TRP . 50.1 mm-40 -97.24 36.86 1.39 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.479 -0.782 . . . . 1.53 110.211 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.8 p90 -67.26 -1.58 4.74 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 121.057 0.456 . . . . 2.35 111.304 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -82.83 -8.8 59.55 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.02 -0.536 . . . . 4.54 109.86 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -131.39 37.75 3.67 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.687 -0.688 . . . . 1.7 110.343 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.427 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -57.36 -52.23 75.78 Favored Pre-proline 0 CA--C 1.537 0.481 0 CA-C-N 115.869 -0.605 . . . . 1.06 112.45 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.432 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 32.4 Cg_endo -64.74 -27.02 60.19 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 121.797 1.665 . . . . 0.62 112.362 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.6 -39.08 77.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.983 -0.553 . . . . 3.25 111.091 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 24.6 m -85.59 -22.58 7.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 120.61 -0.436 . . . . 1.12 110.669 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.36 -46.08 74.42 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.199 -0.455 . . . . 0.99 110.737 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 3.3 pt-20 -64.13 -40.75 96.84 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.257 -0.429 . . . . 1.4 110.052 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.421 ' N ' ' HG3' ' A' ' 41' ' ' GLU . 42.5 ttm -64.67 -41.07 96.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.596 -0.729 . . . . 2.13 110.521 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -62.18 -49.48 75.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.743 -0.662 . . . . 0.47 110.36 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.447 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 23.2 ttpp -57.82 -51.28 70.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.921 -0.581 . . . . 1.71 111.04 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 11.4 mm-40 -61.28 -38.65 87.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.144 -0.48 . . . . 1.96 111.168 -179.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.418 ' O ' HG21 ' A' ' 52' ' ' VAL . 79.1 t80 -62.03 -46.65 88.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.921 0.391 . . . . 2.37 110.67 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 76.9 mmm -67.05 -25.2 66.14 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.2 -0.454 . . . . 1.15 111.407 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 82.0 mt -93.94 12.7 25.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.396 -0.365 . . . . 1.39 111.299 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 11.9 mtp85 -96.66 133.56 24.39 Favored Pre-proline 0 C--N 1.327 -0.401 0 N-CA-C 110.333 -0.247 . . . . 3.14 110.333 179.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -70.28 -15.89 35.26 Favored 'Trans proline' 0 CA--C 1.53 0.284 0 C-N-CA 122.924 2.416 . . . . 1.07 113.307 -179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.69 10.47 7.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.032 0.444 . . . . 1.64 110.946 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.418 HG21 ' O ' ' A' ' 46' ' ' TYR . 41.2 t -110.39 122.0 64.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.949 -0.569 . . . . 1.17 110.514 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -69.01 156.45 38.6 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.96 -0.564 . . . . 2.2 110.93 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.12 -41.81 72.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.876 0.369 . . . . 1.52 111.73 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -68.89 -29.81 68.17 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.423 -0.353 . . . . 4.09 110.497 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.0 mmm-85 -70.96 -38.68 72.82 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.602 -0.518 . . . . 3.61 109.602 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.407 ' HZ1' ' CD ' ' A' ' 97' ' ' GLU . 74.9 mttt -67.21 -34.82 78.3 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.377 -0.601 . . . . 1.15 109.377 178.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 20.1 tp -63.05 -37.97 89.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.581 -0.736 . . . . 1.87 109.927 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 mp -66.25 -40.59 90.3 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.688 -0.687 . . . . 2.11 110.007 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.66 -33.79 88.18 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.916 -0.659 . . . . 0.4 111.562 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.84 -44.13 86.41 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.391 -0.596 . . . . 1.88 109.391 178.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -61.78 -39.47 91.81 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.284 -0.871 . . . . 2.18 110.876 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 20.2 tp -63.6 -41.28 98.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.928 -0.578 . . . . 2.19 110.389 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.471 ' O ' HG23 ' A' ' 68' ' ' VAL . 16.9 tmm? -62.87 -51.57 66.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.886 -0.597 . . . . 1.17 110.699 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -56.11 -35.52 67.15 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.063 0.458 . . . . 2.22 110.923 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -68.67 -58.12 4.7 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.709 -0.678 . . . . 2.15 111.687 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 17.5 m -60.52 -39.86 82.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 113.052 0.76 . . . . 2.07 113.052 -177.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 64' ' ' MET . 30.7 m -72.96 -31.03 34.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 120.515 -0.474 . . . . 1.18 111.88 -178.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -77.7 -43.09 32.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.954 0.407 . . . . 2.59 110.473 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -71.52 -24.89 62.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.197 -0.456 . . . . 2.55 110.588 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.29 -18.72 65.52 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.297 -0.41 . . . . 1.16 110.566 179.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt -68.29 -29.21 67.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.27 -0.423 . . . . 2.55 109.879 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.2 -47.73 28.68 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.965 -0.636 . . . . 0.66 111.574 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -78.75 -7.68 58.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.919 0.39 . . . . 1.91 110.289 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.7 mttp 60.46 40.27 17.37 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.489 -0.778 . . . . 3.18 111.267 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 40.1 mm -93.25 94.79 4.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.766 -0.652 . . . . 1.2 109.813 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 10.9 pt -70.73 -22.47 23.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.083 -0.508 . . . . 1.4 111.224 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -56.23 -33.46 65.41 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.916 0.389 . . . . 2.37 110.702 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -71.51 -53.44 13.85 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.934 -0.576 . . . . 2.23 110.577 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -63.88 -31.54 72.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.82 -0.627 . . . . 1.45 111.799 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -71.23 -57.36 4.56 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.964 0.412 . . . . 1.32 111.426 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.9 m -65.36 -42.35 92.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.878 -0.601 . . . . 1.18 112.327 -178.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -78.32 -28.66 47.38 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.7 -0.4 . . . . 2.13 111.184 -179.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -68.23 -42.9 82.09 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.777 -0.725 . . . . 0.34 113.051 -179.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -65.3 -27.12 68.39 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.019 0.377 . . . . 1.9 112.019 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.6 m -97.26 -18.29 6.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-O 120.772 0.32 . . . . 1.04 111.316 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.23 -45.53 91.2 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.254 -0.43 . . . . 1.09 111.382 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -50.88 -46.69 60.56 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.386 0.429 . . . . 1.13 111.515 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 3.5 tp10 -62.43 -60.03 4.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.76 -0.654 . . . . 1.56 110.529 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.456 ' O ' HG12 ' A' ' 94' ' ' ILE . 80.0 t -54.97 -49.4 71.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.837 -0.619 . . . . 1.15 112.363 -178.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 82.0 mt -61.09 -38.0 84.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.611 0.243 . . . . 2.15 111.629 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -72.22 -31.06 64.2 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.544 -0.836 . . . . 0.41 112.0 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.578 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 47.8 mmm-85 -76.59 -50.35 14.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.514 0.197 . . . . 3.95 111.233 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 90' ' ' VAL . 22.2 pt -65.18 -20.82 28.24 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.282 0 CA-C-O 120.609 0.242 . . . . 1.22 111.167 -179.297 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -62.86 -26.8 68.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.687 0.755 . . . . 1.06 109.677 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -101.59 2.94 39.48 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.469 -0.787 . . . . 1.57 110.785 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.407 ' CD ' ' HZ1' ' A' ' 57' ' ' LYS . 2.7 mt-10 -116.65 -15.87 10.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.134 -0.485 . . . . 1.33 111.281 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -95.1 125.63 49.77 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.22 -0.446 . . . . 2.29 111.193 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -61.79 174.5 2.28 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.719 2.279 . . . . 1.47 112.042 178.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.42 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 14.6 ptt-85 -49.95 -33.46 17.71 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.835 0.68 . . . . 5.56 112.835 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -75.07 -52.77 10.22 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.928 -0.309 . . . . 2.58 111.683 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 35.5 mt -66.75 -35.63 80.56 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.225 0.454 . . . . 1.4 112.225 -178.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -65.83 -30.18 70.76 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.857 -0.337 . . . . 2.83 110.821 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.42 ' HG3' ' O ' ' A' ' 100' ' ' ARG . 43.1 mtmt -68.63 -23.87 64.48 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.329 0.585 . . . . 2.98 109.748 178.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 52.9 mttp -84.14 -28.95 27.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.446 -0.797 . . . . 2.89 108.977 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 26.1 tp -64.51 -45.33 87.74 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.498 -0.774 . . . . 1.81 109.823 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 1.4 p -63.87 -25.87 68.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 1.53 110.674 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 39.3 mtt-85 -72.61 -24.35 61.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.949 -0.569 . . . . 4.16 110.982 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.488 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 49.0 t -91.48 -48.77 13.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 116.081 -0.509 . . . . 1.81 110.105 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 71.8 t -56.66 -44.36 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.67 -0.695 . . . . 1.68 112.187 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.93 -38.46 91.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.616 0.246 . . . . 2.24 111.256 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 57.9 mt -71.02 -40.05 75.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.801 0.334 . . . . 1.8 110.777 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 89.5 mt -58.72 -39.52 81.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 1.98 111.913 -179.237 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 11.7 ptpt -83.08 -40.86 19.3 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.976 -0.289 . . . . 2.17 111.759 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -66.71 -33.83 76.49 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.034 0.383 . . . . 2.2 112.034 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.7 mmm180 -85.73 0.04 53.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.751 -0.204 . . . . 3.8 110.993 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 56.14 52.03 10.95 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.33 0.586 . . . . 2.23 110.116 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 49.7 mm -77.35 -49.12 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.837 -0.62 . . . . 1.26 110.481 -179.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -102.25 171.98 7.16 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.087 -0.506 . . . . 2.11 110.327 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.22 158.83 35.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.998 -0.547 . . . . 1.55 110.341 179.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 125' ' ' ASN . 2.0 mmmt -57.41 -39.82 76.99 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.515 -0.311 . . . . 3.34 111.584 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -66.66 -27.77 67.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.749 0.309 . . . . 3.37 111.141 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 90.0 t -80.73 -51.22 16.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.47 -0.332 . . . . 1.92 111.243 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.506 ' O ' ' HG2' ' A' ' 128' ' ' GLU . 26.9 m -61.74 -30.2 47.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.772 0.32 . . . . 1.92 111.131 -179.451 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . 0.413 ' HB2' ' O ' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -72.29 -27.32 62.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.208 -0.451 . . . . 2.18 110.654 179.589 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -79.16 -36.27 40.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.187 -0.46 . . . . 1.44 110.023 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 81.3 mt -63.4 -54.61 30.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.873 -0.603 . . . . 1.17 111.049 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.506 ' HG2' ' O ' ' A' ' 124' ' ' VAL . 5.2 pt-20 -61.59 -38.68 88.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.351 -0.386 . . . . 2.05 111.794 -178.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -68.15 -29.25 68.1 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.751 -0.38 . . . . 4.63 110.724 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 65.0 m -72.17 -40.36 68.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.839 0.352 . . . . 0.93 110.161 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.1 mp -64.12 -39.42 93.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.191 0.519 . . . . 2.04 109.922 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.05 -42.28 63.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.502 -0.772 . . . . 1.22 111.213 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.44 -25.58 67.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 1.45 111.274 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -72.6 -15.45 61.74 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.096 -0.502 . . . . 1.28 110.75 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 32.0 mt 64.19 12.29 6.98 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.932 -0.576 . . . . 4.46 111.637 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -102.78 68.62 1.03 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.259 0.552 . . . . 6.64 110.574 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 . . . . . 0 C--O 1.244 0.783 0 CA-C-O 118.442 -0.789 . . . . 8.81 109.867 179.683 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 206' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo . . . . . 0 CA--C 1.533 0.44 0 CA-C-O 120.086 -0.048 . . . . 7.93 112.193 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 18.5 m 67.4 99.94 0.05 Allowed 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.745 0.783 . . . . 6.33 112.231 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . 0.497 ' HA ' ' OE1' ' A' ' 19' ' ' GLN . 28.7 t80 -71.09 128.42 35.89 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.705 -0.679 . . . . 4.66 109.958 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 209' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.18 -30.27 90.92 Favored 'Trans proline' 0 N--CA 1.476 0.463 0 C-N-CA 122.813 2.342 . . . . 4.88 112.934 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -91.11 -8.5 48.65 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.099 -0.501 . . . . 5.34 110.889 -179.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 72.6 m -134.76 78.52 54.92 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 109.63 -0.507 . . . . 3.29 109.63 179.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 213' ' ' PRO . . . . . 0.441 ' HA ' ' CE2' ' B' ' 208' ' ' TYR . 11.3 Cg_exo -71.66 -24.1 22.17 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 123.193 2.595 . . . . 4.56 113.139 -178.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 3.4 m . . . . . 0 C--O 1.251 1.147 0 CA-C-O 118.342 -0.837 . . . . 6.05 110.428 -179.464 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.206 0 CA-C-O 120.857 0.361 . . . . 5.77 111.003 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -88.9 160.53 17.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.335 -0.393 . . . . 6.18 110.521 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.13 103.41 0.61 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.892 -0.595 . . . . 3.04 111.273 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.3 m -80.6 157.02 26.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.856 -0.611 . . . . 3.56 110.276 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 58.71 39.39 24.4 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.287 -0.415 . . . . 2.9 111.231 -179.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.46 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 18.5 mt-30 -60.8 -38.44 85.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.29 -0.414 . . . . 3.17 111.521 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.613 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 82.4 t80 -77.12 -43.94 32.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.039 0.447 . . . . 1.44 110.785 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.0 -41.22 96.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.907 -0.588 . . . . 1.38 112.358 -179.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.9 t -69.39 -24.39 63.86 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.709 -0.223 . . . . 1.95 111.408 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 71.2 mmtt -68.11 -37.62 81.35 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.973 0.416 . . . . 1.78 110.052 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -62.22 -32.59 73.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.602 -0.726 . . . . 2.19 111.153 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 54.8 m-20 -77.57 -11.32 59.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.108 -0.496 . . . . 1.96 111.287 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.99 9.66 18.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.843 0.354 . . . . 2.11 111.465 -179.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 17.9 mt -85.94 165.0 17.1 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.129 0.49 . . . . 1.63 111.372 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -144.18 169.58 17.61 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.581 -0.736 . . . . 2.16 109.458 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -84.38 41.9 0.86 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.425 0.631 . . . . 1.94 111.453 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -119.33 139.23 52.3 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.991 -0.55 . . . . 1.89 109.708 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.414 ' HB2' ' O ' ' B' ' 213' ' ' PRO . 5.2 pm0 -61.39 -39.58 91.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.679 -0.237 . . . . 3.13 111.016 -179.097 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.77 -42.22 99.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.123 0.487 . . . . 2.99 110.258 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.8 m -65.28 -46.98 78.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.025 -0.534 . . . . 1.62 111.012 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 38.4 mm -65.39 -44.98 94.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 CA-C-N 116.354 -0.384 . . . . 1.52 110.235 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.9 t -56.18 -43.38 78.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.876 -0.602 . . . . 1.63 111.082 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.0 m -59.21 -36.85 76.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.247 -0.433 . . . . 1.4 111.868 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -83.01 -40.52 19.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.767 0.318 . . . . 1.14 111.111 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.6 m -62.29 -43.64 98.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.301 -0.409 . . . . 1.62 111.038 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.613 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 0.3 OUTLIER -64.06 -38.74 92.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.318 -0.401 . . . . 2.76 110.095 179.67 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 37.5 t90 -64.89 -38.57 91.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.025 -0.534 . . . . 1.14 110.287 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -67.09 -45.31 77.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.98 -0.555 . . . . 1.91 111.142 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 74.1 mt -64.26 -21.37 66.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.961 -0.563 . . . . 1.71 112.052 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 66.0 mt -70.64 -24.45 62.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.752 0.311 . . . . 2.2 110.991 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.417 ' C ' ' H ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -129.15 72.08 1.45 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.087 0.47 . . . . 1.53 110.991 -179.573 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.5 p90 -75.17 9.18 2.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.94 -0.573 . . . . 2.35 110.729 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.417 ' H ' ' C ' ' A' ' 32' ' ' GLN . 33.1 mtp-105 -71.0 -25.1 62.54 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.782 -0.644 . . . . 4.54 110.499 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -117.13 33.3 5.69 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.128 -0.487 . . . . 1.7 110.645 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.422 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -54.62 -51.65 76.71 Favored Pre-proline 0 CA--C 1.538 0.485 0 CA-C-N 115.512 -0.767 . . . . 1.06 112.282 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.422 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 35.5 Cg_endo -66.03 -29.49 48.62 Favored 'Trans proline' 0 C--N 1.356 0.936 0 C-N-CA 121.602 1.535 . . . . 0.62 112.182 179.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.6 tptm -70.58 -45.96 64.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.46 -0.336 . . . . 3.25 110.867 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 35.5 m -72.64 -25.79 23.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 120.837 -0.345 . . . . 1.12 110.49 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.37 -50.12 49.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 0.99 110.655 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -66.67 -35.32 79.86 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 110.207 -0.294 . . . . 1.4 110.207 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.613 ' SD ' ' HB3' ' A' ' 8' ' ' PHE . 57.0 ttm -66.48 -40.82 89.52 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.02 0.438 . . . . 2.13 109.839 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -60.29 -49.13 78.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.508 -0.769 . . . . 0.47 109.503 178.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -57.39 -46.68 83.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.092 -0.958 . . . . 1.71 110.837 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -62.97 -43.89 97.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.801 -0.636 . . . . 1.96 111.413 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.428 ' O ' HG21 ' A' ' 52' ' ' VAL . 81.2 t80 -64.67 -45.14 87.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.884 0.373 . . . . 2.37 111.227 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 56.4 mmm -67.4 -22.53 65.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.138 -0.483 . . . . 1.15 112.051 -178.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.7 mt -103.72 32.35 3.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.917 0.389 . . . . 1.39 111.579 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 59.3 mtp180 -113.76 144.02 30.64 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 116.364 -0.38 . . . . 3.14 110.567 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.35 -16.31 31.18 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.833 2.355 . . . . 1.07 112.613 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.05 4.8 21.58 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.014 -0.539 . . . . 1.64 111.255 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.428 HG21 ' O ' ' A' ' 46' ' ' TYR . 41.3 t -115.33 120.9 66.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.299 -0.41 . . . . 1.17 110.789 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -74.41 155.16 38.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.842 -0.617 . . . . 2.2 110.614 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.65 -36.96 62.67 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 122.876 0.47 . . . . 1.52 112.214 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -35.02 78.84 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.961 0.41 . . . . 4.09 110.451 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.4 mmm-85 -73.9 -37.21 64.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.079 -0.51 . . . . 3.61 110.544 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.437 ' HZ1' ' CD ' ' A' ' 97' ' ' GLU . 78.3 mttt -65.83 -32.25 73.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.049 -0.523 . . . . 1.15 109.755 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 32.0 tp -66.48 -40.64 89.41 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.072 -0.714 . . . . 1.87 109.072 178.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.6 mp -68.62 -39.81 80.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.503 -0.771 . . . . 2.11 110.187 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.34 -34.89 90.66 Favored Glycine 0 N--CA 1.452 -0.273 0 N-CA-C 111.58 -0.608 . . . . 0.4 111.58 179.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.2 tt -66.62 -39.97 88.58 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.335 -0.617 . . . . 1.88 109.335 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -61.32 -40.27 93.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.592 -0.731 . . . . 2.18 110.823 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.8 tp -62.16 -45.65 92.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.206 -0.452 . . . . 2.19 110.302 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.497 ' O ' HG23 ' A' ' 68' ' ' VAL . 16.0 tmm? -62.93 -47.17 84.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.854 -0.612 . . . . 1.17 109.838 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -56.45 -39.11 72.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.51 -0.768 . . . . 2.22 111.525 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -69.36 -53.0 21.72 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.004 -0.543 . . . . 2.15 111.447 -179.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 34.4 m -63.39 -32.6 57.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 112.731 0.641 . . . . 2.07 112.731 -178.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 64' ' ' MET . 34.5 m -80.07 -31.95 13.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.446 -0.502 . . . . 1.18 111.67 -179.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -75.48 -35.74 60.77 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.982 0.42 . . . . 2.59 110.594 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -84.09 -11.65 56.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.209 -0.45 . . . . 2.55 111.315 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.6 -23.46 66.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.445 -0.343 . . . . 1.16 111.087 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -66.77 -38.36 86.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.253 -0.431 . . . . 2.55 110.386 179.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -73.32 -30.52 62.5 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.923 -0.655 . . . . 0.66 111.658 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -81.13 -15.49 55.71 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.817 0.342 . . . . 1.91 110.329 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 62.9 mttp 65.1 26.67 12.51 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.446 -0.797 . . . . 3.18 110.679 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 36.7 mm -109.68 86.37 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.638 -0.71 . . . . 1.2 109.423 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.408 HG13 ' OE1' ' A' ' 78' ' ' GLN . 2.0 pp -73.11 -12.05 15.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.123 -0.489 . . . . 1.4 110.753 -179.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.408 ' OE1' HG13 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -59.74 -35.57 74.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.962 -0.563 . . . . 2.37 110.165 179.321 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.51 -43.7 89.25 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.299 0.571 . . . . 2.23 109.5 178.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -68.92 -36.97 78.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.194 -0.912 . . . . 1.45 111.191 -179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.402 ' O ' ' HG2' ' A' ' 85' ' ' LYS . 30.2 t70 -69.96 -43.95 70.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.901 0.382 . . . . 1.32 110.931 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.412 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 39.8 m -62.87 -44.44 96.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.052 -0.522 . . . . 1.18 111.193 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -79.22 -33.39 43.76 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-N 116.318 -0.401 . . . . 2.13 111.297 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.15 -44.27 94.9 Favored Glycine 0 N--CA 1.453 -0.226 0 N-CA-C 114.211 0.445 . . . . 0.34 114.211 -178.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.412 ' HE2' ' HA ' ' A' ' 82' ' ' SER . 0.0 OUTLIER -66.18 -20.88 66.27 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.204 0.446 . . . . 1.9 112.204 -178.772 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 20.4 m -106.41 -17.2 7.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.898 0.38 . . . . 1.04 110.902 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.76 -46.98 85.52 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.131 -0.486 . . . . 1.09 111.011 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.49 -40.43 71.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.254 -0.43 . . . . 1.13 110.735 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -66.27 -58.61 4.98 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.805 -0.634 . . . . 1.56 110.169 179.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.505 ' O ' HG12 ' A' ' 94' ' ' ILE . 81.7 t -56.02 -49.72 73.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.945 -0.571 . . . . 1.15 111.905 -178.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 94.8 mt -59.03 -43.45 91.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.817 -0.174 . . . . 2.15 111.424 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -65.82 -32.29 82.39 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.757 -0.735 . . . . 0.41 112.401 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 34.7 mmm-85 -77.55 -52.93 8.24 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.528 0.204 . . . . 3.95 111.245 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.505 HG12 ' O ' ' A' ' 90' ' ' VAL . 37.9 pt -66.97 -18.8 24.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.452 -0.34 . . . . 1.22 111.361 -179.048 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -61.64 -30.93 71.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.394 0.616 . . . . 1.06 109.812 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -85.74 -14.98 43.62 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.576 -0.738 . . . . 1.57 110.375 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.437 ' CD ' ' HZ1' ' A' ' 57' ' ' LYS . 53.9 mt-10 -92.11 -38.12 12.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.907 -0.588 . . . . 1.33 110.773 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 -67.28 122.03 81.16 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.566 -0.743 . . . . 2.29 111.383 -179.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -71.85 -175.88 1.84 Allowed 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.476 2.117 . . . . 1.47 112.337 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 15.9 ptt-85 -55.56 -27.37 48.76 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 113.119 0.785 . . . . 5.56 113.119 -178.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.425 ' HA ' ' CE ' ' A' ' 104' ' ' LYS . 33.4 t70 -81.15 -46.09 15.42 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.654 -0.418 . . . . 2.58 111.845 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 22.5 mt -73.86 -29.2 61.97 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.363 0.505 . . . . 1.4 112.363 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 57.1 pttt -58.85 -28.42 66.06 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.792 0.329 . . . . 2.83 111.149 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.425 ' CE ' ' HA ' ' A' ' 101' ' ' ASP . 41.0 mtmt -64.42 -50.91 65.72 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.04 0.448 . . . . 2.98 110.599 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 40.9 mttp -68.47 -33.55 74.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.854 -0.612 . . . . 2.89 110.093 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 16.6 tp -63.39 -48.26 78.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.717 -0.674 . . . . 1.81 110.641 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.8 p -66.57 -33.57 75.96 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.941 -0.304 . . . . 1.53 110.796 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 39.0 mtt180 -64.08 -52.43 59.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.157 -0.474 . . . . 4.16 111.472 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.471 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 6.2 p -61.48 -42.17 92.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 121.085 -0.246 . . . . 1.81 110.961 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 50.5 t -60.4 -43.89 94.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 121.017 0.437 . . . . 1.68 110.175 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . 0.402 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 2.7 t-20 -60.11 -47.34 86.29 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.589 -0.732 . . . . 2.24 110.693 179.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 78.8 mt -63.59 -44.35 98.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.305 -0.407 . . . . 1.8 111.139 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 87.1 mt -60.28 -44.01 95.73 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.973 0.36 . . . . 1.98 111.973 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.402 ' HG3' ' O ' ' A' ' 111' ' ' ASN . 2.0 ptpt -75.1 -35.4 61.76 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.91 -0.316 . . . . 2.17 111.506 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -71.07 -27.07 63.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.634 0.255 . . . . 2.2 111.282 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 6.4 mtt-85 -90.76 -4.0 57.0 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.67 -0.493 . . . . 3.8 109.67 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 56.09 54.89 7.37 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.089 -0.959 . . . . 2.23 110.16 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 37.8 mm -73.86 -45.83 48.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.344 -0.844 . . . . 1.26 110.602 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -100.31 171.53 7.72 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.966 -0.561 . . . . 2.11 110.736 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.8 163.08 20.09 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.931 -0.577 . . . . 1.55 111.224 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.3 mmmp? -55.4 -43.38 75.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 3.34 111.683 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.92 -23.05 64.12 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.016 -0.538 . . . . 3.37 111.659 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 61.4 t -85.19 -49.18 15.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 121.144 -0.223 . . . . 1.92 111.26 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 27.8 m -61.17 -30.54 48.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.883 0.373 . . . . 1.92 111.181 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -80.84 -28.46 36.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 2.18 110.86 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.429 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 10.9 t70 -73.41 -40.55 64.18 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.017 0.437 . . . . 1.44 110.179 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 91.0 mt -60.62 -52.51 60.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.98 -0.555 . . . . 1.17 111.526 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -63.11 -33.98 76.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.227 0.454 . . . . 2.05 112.227 -178.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 13.1 ptt180 -74.81 -33.81 62.26 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.426 -0.51 . . . . 4.63 110.943 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 39.3 m -66.04 -44.62 84.1 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.983 0.42 . . . . 0.93 110.734 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.5 mp -62.04 -36.83 82.77 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.119 -0.491 . . . . 2.04 110.447 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.36 -41.15 66.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.785 -0.643 . . . . 1.22 110.851 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.05 -34.11 74.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.366 -0.379 . . . . 1.45 111.432 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.18 -19.37 63.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.447 . . . . 1.28 111.177 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 55.7 mt 53.79 45.01 28.77 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.913 -0.585 . . . . 4.46 111.819 179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -107.11 35.11 3.15 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.341 0.591 . . . . 6.64 109.746 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.736 -0.65 . . . . 8.81 109.893 179.943 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 206' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo . . . . . 0 N--CA 1.482 0.817 0 N-CA-C 111.67 -0.165 . . . . 7.93 111.67 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 48.9 m 63.38 102.88 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.982 0.896 . . . . 6.33 112.246 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . 0.415 ' OH ' ' HA ' ' B' ' 213' ' ' PRO . 41.6 t80 -81.26 130.23 34.94 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.576 -0.738 . . . . 4.66 111.128 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 209' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_exo -58.0 -24.13 63.85 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.07 2.513 . . . . 4.88 112.715 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 1.5 m -81.4 -8.42 59.73 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.236 0.541 . . . . 5.34 110.523 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 10.0 m -134.52 71.44 71.35 Favored Pre-proline 0 C--O 1.236 0.387 0 CA-C-N 116.181 -0.463 . . . . 3.29 110.394 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 213' ' ' PRO . . . . . 0.415 ' HA ' ' OH ' ' B' ' 208' ' ' TYR . 27.6 Cg_endo -61.67 -42.91 29.33 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.857 2.372 . . . . 4.56 112.814 -179.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.304 -0.855 . . . . 6.05 108.916 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 120.514 0.197 . . . . 5.77 110.797 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -91.67 167.74 11.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.99 0.424 . . . . 6.18 110.577 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m -81.79 67.59 7.83 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.273 -0.421 . . . . 3.04 110.504 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.43 -21.48 66.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.039 0.447 . . . . 3.56 110.782 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -67.13 -14.94 63.39 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.735 -0.666 . . . . 2.9 111.54 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.419 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 97.0 mt-30 -64.34 -31.33 72.49 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.091 0.472 . . . . 3.17 109.737 179.111 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -72.6 -49.57 31.24 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.86 -0.609 . . . . 1.44 110.11 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -36.67 80.21 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.784 -0.644 . . . . 1.38 112.015 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.1 t -72.66 -26.95 61.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.455 -0.339 . . . . 1.95 110.674 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.419 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 22.6 mmmt -69.37 -27.78 65.62 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-O 120.701 0.286 . . . . 1.78 110.589 179.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.86 -29.87 71.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.956 -0.566 . . . . 2.19 110.577 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -81.48 -20.8 39.44 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.054 -0.521 . . . . 1.96 110.496 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.2 p -101.16 24.69 9.09 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.066 -0.515 . . . . 2.11 111.554 -179.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 15.8 mt -77.36 165.44 24.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.037 0.446 . . . . 1.63 111.373 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -144.88 168.25 20.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.82 -0.627 . . . . 2.16 109.377 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -82.62 -20.85 35.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.663 0.268 . . . . 1.94 111.316 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.446 ' HB2' ' OG ' ' A' ' 21' ' ' SER . 3.5 m -61.61 133.87 56.15 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 1.89 111.082 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.02 -34.89 79.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.85 -0.614 . . . . 3.13 110.554 -178.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -66.15 -38.66 88.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.821 -0.627 . . . . 2.99 110.745 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.446 ' OG ' ' HB2' ' A' ' 18' ' ' SER . 4.3 m -68.16 -38.9 82.61 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.147 -0.479 . . . . 1.62 110.163 179.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.9 mm -67.32 -34.97 72.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 N-CA-C 109.047 -0.723 . . . . 1.52 109.047 178.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.0 m -63.26 -33.78 76.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.185 -0.916 . . . . 1.63 111.179 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.1 m -62.43 -47.58 83.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 1.4 110.722 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.35 -40.66 81.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.101 -0.5 . . . . 1.14 110.632 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 29.1 t -61.32 -48.89 79.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.025 -0.534 . . . . 1.62 110.771 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -26.8 68.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 2.76 111.1 -179.583 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 13.9 t90 -78.15 -37.83 45.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.153 -0.476 . . . . 1.14 110.169 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -67.52 -35.4 79.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.669 -0.696 . . . . 1.91 110.911 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.7 -23.9 67.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.408 -0.36 . . . . 1.71 111.774 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 68.4 mt -81.09 -20.75 40.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.074 0.464 . . . . 2.2 111.065 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -110.27 41.45 1.74 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.11 0.481 . . . . 1.53 110.443 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 54.6 p90 -59.11 -20.6 54.95 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.802 -0.635 . . . . 2.35 112.098 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.3 ttp180 -71.47 -25.49 62.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.034 0.445 . . . . 4.54 110.711 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.33 16.97 25.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.897 -0.592 . . . . 1.7 110.739 -179.464 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.499 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.38 -50.88 77.27 Favored Pre-proline 0 CA--C 1.536 0.404 0 CA-C-N 115.735 -0.666 . . . . 1.06 112.51 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.499 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 18.1 Cg_endo -59.81 -31.69 94.32 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 121.83 1.687 . . . . 0.62 112.708 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.3 tptt -76.57 -41.22 47.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.318 -0.401 . . . . 3.25 111.345 -178.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.1 m -73.17 -29.77 29.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 C-N-CA 120.396 -0.522 . . . . 1.12 110.546 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.83 -46.41 71.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.185 -0.461 . . . . 0.99 111.34 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 7.4 pt-20 -64.84 -40.78 95.72 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 110.049 -0.352 . . . . 1.4 110.049 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 65.7 mtm -65.47 -37.31 86.47 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.961 0.41 . . . . 2.13 109.945 179.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 63.5 t90 -59.55 -48.27 82.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.493 -0.776 . . . . 0.47 109.742 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.9 ttpt -60.83 -45.07 95.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.209 -0.451 . . . . 1.71 110.676 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.533 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 10.0 mm-40 -60.53 -47.09 87.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.963 -0.562 . . . . 1.96 110.851 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -65.43 -44.18 88.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 2.37 111.115 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 70.3 mmm -66.16 -22.98 66.39 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.104 0.409 . . . . 1.15 112.104 -179.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.3 mt -99.68 7.47 45.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.602 0.239 . . . . 1.39 111.487 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.533 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 41.9 mtp180 -84.92 132.57 45.49 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.954 -0.387 . . . . 3.14 109.954 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -67.07 -11.69 33.23 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.754 2.303 . . . . 1.07 112.59 -179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -16.43 59.24 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.171 0.51 . . . . 1.64 110.6 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.2 t -92.18 123.87 44.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.799 -0.637 . . . . 1.17 110.769 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -69.61 153.31 43.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.795 -0.639 . . . . 2.2 110.601 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.35 -39.69 64.35 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.017 -0.538 . . . . 1.52 112.354 -179.477 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -68.82 -32.6 72.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.845 0.355 . . . . 4.09 110.954 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.7 mmt85 -71.45 -32.65 68.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.314 -0.403 . . . . 3.61 110.016 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.1 mttt -67.65 -34.29 76.66 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.452 -0.573 . . . . 1.15 109.452 178.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 40.8 tp -63.3 -43.64 97.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.773 -0.648 . . . . 1.87 109.797 178.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 94.1 mt -65.47 -40.76 93.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.812 -0.631 . . . . 2.11 110.034 179.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.9 -30.69 78.46 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.983 -0.627 . . . . 0.4 111.743 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 25.8 tp -71.78 -38.82 70.25 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.918 0.389 . . . . 1.88 110.138 178.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -65.96 -31.37 72.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.961 -0.563 . . . . 2.18 110.568 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 56.7 tp -65.73 -44.5 85.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.956 -0.565 . . . . 2.19 110.627 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.479 ' HG3' ' N ' ' A' ' 65' ' ' ASN . 0.0 OUTLIER -67.13 -34.61 77.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 1.17 110.841 -179.61 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.479 ' N ' ' HG3' ' A' ' 64' ' ' MET . 11.2 t30 -63.44 -37.29 86.73 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.343 0.592 . . . . 2.22 110.528 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -68.22 -52.87 29.3 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.382 -0.826 . . . . 2.15 111.295 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 7.1 p -63.43 -39.42 85.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 112.9 0.704 . . . . 2.07 112.9 -177.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 64' ' ' MET . 33.5 m -73.57 -24.58 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 C-N-CA 120.416 -0.514 . . . . 1.18 111.517 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -75.18 -47.66 27.3 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.111 -0.329 . . . . 2.59 110.111 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -72.08 -23.16 61.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.186 -0.461 . . . . 2.55 110.732 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.09 -29.09 70.07 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-N 116.392 -0.367 . . . . 1.16 111.125 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.452 ' HD2' ' HA ' ' A' ' 118' ' ' ILE . 42.8 mtpt -68.01 -34.88 77.34 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.441 -0.345 . . . . 2.55 110.371 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.46 -30.4 75.08 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.924 -0.655 . . . . 0.66 111.753 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -95.62 -2.09 48.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.731 0.3 . . . . 1.91 110.447 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm 62.01 23.75 14.04 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.686 -0.688 . . . . 3.18 112.121 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 23.3 mm -86.36 78.91 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.861 -0.422 . . . . 1.2 109.861 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 10.3 pt -64.42 -11.71 10.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.861 -0.609 . . . . 1.4 111.71 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.96 -26.75 68.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.095 -0.502 . . . . 2.37 110.492 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -73.5 -51.23 17.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 2.23 110.865 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -63.96 -28.65 69.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 1.45 111.311 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -73.24 -50.28 23.22 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.208 0.527 . . . . 1.32 109.968 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.4 m -64.4 -47.1 80.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.455 -0.793 . . . . 1.18 111.65 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -76.77 -30.22 56.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.605 0.24 . . . . 2.13 111.308 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.7 -42.21 93.38 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.078 -0.582 . . . . 0.34 113.479 -179.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 9.7 ptpt -60.55 -27.06 67.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.752 0.276 . . . . 1.9 111.539 -179.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.1 m -103.29 -14.64 8.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.707 0.289 . . . . 1.04 111.564 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.74 -44.61 93.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.427 -0.351 . . . . 1.09 111.323 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.27 -36.81 69.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.098 0.475 . . . . 1.13 111.016 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 5.8 tp10 -72.69 -58.61 3.22 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.598 -0.728 . . . . 1.56 110.62 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 96.2 t -54.91 -50.34 62.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.85 -0.614 . . . . 1.15 112.107 -178.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -58.24 -42.22 85.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.531 0.205 . . . . 2.15 111.355 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -67.66 -35.06 85.24 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.573 -0.823 . . . . 0.41 112.426 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 15.8 mmp_? -75.68 -48.76 20.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.548 0.213 . . . . 3.95 111.566 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 43.5 pt -65.97 -25.46 36.09 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 C-N-CA 121.062 -0.255 . . . . 1.22 111.589 -178.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -63.15 -21.79 66.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.432 0.634 . . . . 1.06 110.189 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -97.27 -33.73 11.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.722 -0.672 . . . . 1.57 110.804 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -76.3 -32.83 58.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 1.33 111.055 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -80.82 132.83 56.4 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.12 -0.491 . . . . 2.29 110.226 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -63.42 166.35 15.41 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.352 2.035 . . . . 1.47 110.835 178.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.441 ' O ' ' HE2' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -59.44 -21.61 60.28 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.945 0.35 . . . . 5.56 111.945 -178.758 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.27 -25.79 51.8 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.831 0.348 . . . . 2.58 110.969 179.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 26.4 mt -98.66 -26.81 14.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.575 -0.284 . . . . 1.4 111.736 -178.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . 0.467 ' HA ' ' CD2' ' A' ' 106' ' ' LEU . 0.0 OUTLIER -61.13 -25.19 66.82 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.002 0.429 . . . . 2.83 110.541 -179.87 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.537 ' O ' ' HG3' ' A' ' 108' ' ' ARG . 53.2 mttm -65.48 -35.39 80.77 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.028 -0.533 . . . . 2.98 110.216 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 18.5 mtpp -69.94 -49.89 47.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.945 -0.57 . . . . 2.89 110.925 -179.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.467 ' CD2' ' HA ' ' A' ' 103' ' ' LYS . 3.2 pp -65.78 -27.92 68.63 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.684 0.278 . . . . 1.81 110.657 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.1 t -63.78 -37.64 88.13 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.265 -0.425 . . . . 1.53 110.03 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.537 ' HG3' ' O ' ' A' ' 104' ' ' LYS . 8.3 mtp85 -66.42 -40.66 89.69 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.423 -0.584 . . . . 4.16 109.423 179.18 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.572 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 47.3 t -59.56 -56.95 13.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.159 -0.928 . . . . 1.81 110.732 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 44.7 t -57.85 -41.19 79.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.078 -0.51 . . . . 1.68 111.13 -179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -58.92 -49.08 79.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.301 -0.409 . . . . 2.24 110.524 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 96.9 mt -65.18 -38.3 82.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.712 0.291 . . . . 1.8 110.685 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 96.0 mt -59.67 -43.21 94.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.312 -0.404 . . . . 1.98 111.231 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -79.94 -33.25 39.81 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.899 -0.321 . . . . 2.17 111.07 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -66.0 -44.7 84.01 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.717 0.294 . . . . 2.2 111.022 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 85.8 mtt180 -87.03 7.27 28.44 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.548 -0.296 . . . . 3.8 111.103 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 47.84 58.89 4.59 Favored 'General case' 0 C--O 1.235 0.315 0 O-C-N 123.77 0.669 . . . . 2.23 110.84 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.452 ' HA ' ' HD2' ' A' ' 72' ' ' LYS . 40.4 mm -73.65 -48.02 42.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.855 -0.612 . . . . 1.26 110.939 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -101.93 174.76 5.8 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.024 -0.535 . . . . 2.11 110.838 -179.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' SER . . . . . 0.417 ' O ' HG22 ' A' ' 124' ' ' VAL . 26.7 t -71.18 139.6 50.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.058 -0.519 . . . . 1.55 109.761 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -53.23 -30.35 37.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.417 -0.356 . . . . 3.34 111.712 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 6.1 mm100 -61.92 -49.48 76.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.93 0.395 . . . . 3.37 111.132 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.532 ' O ' HG13 ' A' ' 127' ' ' ILE . 3.9 p -79.22 -27.89 13.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.301 -0.409 . . . . 1.92 111.032 -179.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.417 HG22 ' O ' ' A' ' 120' ' ' SER . 43.3 t -60.98 -42.21 92.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.206 0.527 . . . . 1.92 109.81 179.164 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -61.88 -37.89 86.27 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.442 -0.799 . . . . 2.18 110.391 179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -67.35 -36.48 81.5 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.142 -0.481 . . . . 1.44 110.452 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . 0.532 HG13 ' O ' ' A' ' 123' ' ' VAL . 70.1 mt -63.58 -49.33 82.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.084 0.469 . . . . 1.17 109.832 178.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -62.06 -40.1 94.64 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.743 -0.662 . . . . 2.05 110.544 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 41.7 mmt-85 -62.1 -43.47 98.77 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.255 -0.43 . . . . 4.63 110.354 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 50.7 m -64.44 -37.65 88.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.727 -0.67 . . . . 0.93 110.783 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 127' ' ' ILE . 73.5 mt -66.43 -46.01 77.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.35 -0.386 . . . . 2.04 110.88 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . 0.431 ' O ' ' HG3' ' A' ' 136' ' ' GLU . . . -68.14 -29.82 68.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 1.22 111.021 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.77 -21.77 64.85 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.028 -0.533 . . . . 1.45 111.727 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -73.82 -18.67 60.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.421 . . . . 1.28 111.108 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.65 20.99 10.19 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.886 0.374 . . . . 4.46 111.063 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.431 ' HG3' ' O ' ' A' ' 132' ' ' ALA . 65.9 mt-10 -82.98 -4.89 58.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.158 0.504 . . . . 6.64 110.351 179.068 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 81.1 t60 . . . . . 0 C--O 1.244 0.8 0 CA-C-O 118.141 -0.933 . . . . 8.81 109.239 179.225 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 206' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_exo . . . . . 0 N--CA 1.475 0.431 0 N-CA-C 112.679 0.223 . . . . 7.93 112.679 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 49.4 m 65.05 98.02 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.413 0.625 . . . . 6.33 111.552 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -53.98 123.06 11.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.099 -0.5 . . . . 4.66 111.63 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 209' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -60.2 -25.74 80.8 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.743 2.295 . . . . 4.88 112.552 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.83 2.64 56.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.267 0.556 . . . . 5.34 111.104 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 6.7 m -144.51 81.07 11.4 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 116.18 -0.463 . . . . 3.29 109.777 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 213' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -70.39 -55.31 0.16 Allowed 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.42 2.08 . . . . 4.56 113.258 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.199 0 CA-C-O 118.03 -0.986 . . . . 6.05 110.241 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.927 0 CA-C-O 120.739 0.305 . . . . 5.77 110.541 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -116.67 152.65 33.82 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.123 -0.49 . . . . 6.18 110.066 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.6 m -141.78 95.23 2.78 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.866 0.365 . . . . 3.04 110.607 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.9 m -75.17 -19.33 59.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.867 -0.606 . . . . 3.56 109.794 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -84.57 16.1 3.39 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.64 -0.709 . . . . 2.9 110.151 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.416 ' O ' HG22 ' A' ' 10' ' ' THR . 9.8 pt20 -60.05 -33.22 71.76 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.706 -0.679 . . . . 3.17 111.252 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -75.16 -43.0 54.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.979 0.418 . . . . 1.44 110.052 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.97 -39.16 93.85 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.978 -0.556 . . . . 1.38 111.438 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.416 HG22 ' O ' ' A' ' 7' ' ' GLN . 1.2 t -69.83 -24.12 63.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.45 -0.341 . . . . 1.95 110.783 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -71.9 -36.83 70.14 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 109.996 -0.372 . . . . 1.78 109.996 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -68.08 -26.99 66.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.951 -0.568 . . . . 2.19 110.508 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -70.28 -34.34 72.66 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.742 -0.663 . . . . 1.96 110.464 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.6 t -105.2 17.19 24.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.903 -0.59 . . . . 2.11 110.442 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.2 126.88 31.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.863 -0.608 . . . . 1.63 110.291 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -115.29 151.99 33.56 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.663 -0.699 . . . . 2.16 109.557 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -80.19 40.53 0.49 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.506 0.67 . . . . 1.94 111.119 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.51 ' O ' HG12 ' A' ' 22' ' ' ILE . 3.5 m -107.18 146.66 31.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.561 -0.745 . . . . 1.89 110.063 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.1 -32.96 74.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.066 -0.515 . . . . 3.13 110.16 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -66.59 -49.67 65.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.069 -0.514 . . . . 2.99 109.838 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.437 ' OG ' ' HB2' ' A' ' 18' ' ' SER . 1.2 m -56.6 -48.77 76.71 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.905 -0.588 . . . . 1.62 111.777 -179.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.51 HG12 ' O ' ' A' ' 18' ' ' SER . 9.4 mm -64.44 -45.8 94.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.577 -0.283 . . . . 1.52 110.979 -179.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.7 m -66.4 -39.44 89.03 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 111.827 0.306 . . . . 1.63 111.827 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.0 t -59.64 -47.33 86.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.064 0.459 . . . . 1.4 110.152 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.36 -34.0 72.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.968 -0.56 . . . . 1.14 110.799 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.5 t -59.06 -52.67 64.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.175 -0.466 . . . . 1.62 110.283 179.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.7 mmtp -62.97 -37.95 89.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.093 -0.503 . . . . 2.76 110.395 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 20.6 t90 -61.7 -39.05 90.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.505 -0.77 . . . . 1.14 110.303 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -74.05 -42.23 60.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.715 -0.675 . . . . 1.91 110.515 179.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 mp -59.85 -23.26 63.24 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.093 -0.503 . . . . 1.71 111.585 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 78.3 mt -75.82 -32.04 59.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.458 -0.337 . . . . 2.2 110.528 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -103.08 48.12 0.86 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.58 0.705 . . . . 1.53 110.168 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.443 ' HA ' ' CE2' ' A' ' 79' ' ' PHE . 34.0 p90 -57.89 -23.24 52.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.259 -0.882 . . . . 2.35 112.09 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.7 mtp-105 -71.75 -18.73 62.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.912 0.387 . . . . 4.54 111.143 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.04 21.72 16.86 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.941 0.4 . . . . 1.7 110.817 -179.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.465 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.26 -49.45 84.9 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 115.446 -0.797 . . . . 1.06 112.521 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.575 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 35.3 Cg_endo -65.46 -34.56 42.66 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 121.548 1.499 . . . . 0.62 112.745 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.4 ttmt -66.47 -47.04 74.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.677 0.275 . . . . 3.25 111.688 -179.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.435 ' HA ' ' SD ' ' A' ' 42' ' ' MET . 26.9 m -73.14 -22.93 19.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 C-N-CA 120.777 -0.369 . . . . 1.12 111.053 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.422 ' HA ' ' CE1' ' A' ' 83' ' ' PHE . . . -71.94 -50.1 31.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.391 -0.368 . . . . 0.99 111.029 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.575 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 5.0 pt-20 -63.69 -44.32 94.05 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.347 -0.388 . . . . 1.4 111.283 -179.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.435 ' SD ' ' HA ' ' A' ' 39' ' ' VAL . 16.5 ptm -65.88 -33.44 75.85 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.484 0.183 . . . . 2.13 110.915 -179.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 64.7 t90 -64.94 -45.49 85.56 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.158 -0.682 . . . . 0.47 109.158 178.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.464 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 16.9 ttpt -60.16 -49.5 77.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.277 -0.874 . . . . 1.71 110.426 179.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.51 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 6.7 mm-40 -58.48 -42.51 87.71 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.04 0.448 . . . . 1.96 110.58 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -63.66 -42.75 98.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.761 -0.654 . . . . 2.37 111.217 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 71.6 mmm -72.74 -23.6 60.86 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.129 -0.487 . . . . 1.15 112.311 -178.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 71.0 mt -85.27 -16.8 38.92 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 111.942 0.349 . . . . 1.39 111.942 -179.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.51 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 57.0 mtm180 -70.67 133.85 86.48 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.737 0.304 . . . . 3.14 111.401 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.2 -13.63 20.95 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.858 2.372 . . . . 1.07 112.37 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -9.68 58.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.988 -0.551 . . . . 1.64 110.793 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 34.0 t -104.63 125.81 59.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.796 -0.638 . . . . 1.17 109.743 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -72.74 163.28 28.35 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.057 0.456 . . . . 2.2 111.005 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.22 -34.44 73.66 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.123 0.786 . . . . 1.52 113.123 -178.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -62.6 -43.92 97.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.769 0.319 . . . . 4.09 110.68 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -65.28 -37.38 87.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 3.61 110.359 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -65.77 -36.15 82.74 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.908 -0.587 . . . . 1.15 110.327 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 32.9 tp -62.85 -41.32 99.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.125 -0.489 . . . . 1.87 110.032 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.4 mp -69.39 -35.98 76.32 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.03 -0.532 . . . . 2.11 110.16 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.11 -32.46 84.12 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.758 -0.734 . . . . 0.4 111.313 178.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 37.2 tp -68.16 -37.13 80.67 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.97 0.414 . . . . 1.88 110.218 179.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -64.57 -39.47 93.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.842 -0.617 . . . . 2.18 110.499 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.0 tp -63.67 -44.61 93.26 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.082 -0.508 . . . . 2.19 110.481 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.469 ' O ' HG21 ' A' ' 68' ' ' VAL . 13.6 tmm? -60.13 -41.58 92.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.013 -0.54 . . . . 1.17 109.763 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.488 ' O ' ' HB2' ' A' ' 69' ' ' GLN . 1.4 t30 -60.05 -41.74 92.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.601 -0.727 . . . . 2.22 111.301 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.504 ' CD2' ' HH ' ' B' ' 208' ' ' TYR . 1.8 t-80 -67.79 -47.72 68.32 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.114 0.413 . . . . 2.15 112.114 -178.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 31.1 m -63.33 -32.13 55.35 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 112.669 0.618 . . . . 2.07 112.669 -178.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.469 HG21 ' O ' ' A' ' 64' ' ' MET . 34.2 m -88.59 -18.96 7.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.613 -0.435 . . . . 1.18 111.09 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.488 ' HB2' ' O ' ' A' ' 65' ' ' ASN . 6.2 tp-100 -76.77 -49.35 16.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 2.59 110.831 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 55.4 mm-40 -82.16 -6.15 58.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.185 -0.461 . . . . 2.55 111.035 -179.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.3 -33.47 72.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.317 -0.401 . . . . 1.16 111.519 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -67.02 -28.68 68.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.65 -0.25 . . . . 2.55 111.24 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.56 -38.53 95.83 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.918 -0.658 . . . . 0.66 111.93 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -100.57 0.82 40.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.653 0.263 . . . . 1.91 110.743 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? 63.02 37.75 11.47 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.824 -0.626 . . . . 3.18 111.009 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.4 mm -92.32 81.86 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.367 0.603 . . . . 1.2 109.755 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 44.1 pt -73.78 -11.37 14.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.616 -0.72 . . . . 1.4 111.249 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -61.8 -47.57 84.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.11 -0.496 . . . . 2.37 110.628 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.443 ' CE2' ' HA ' ' A' ' 33' ' ' TYR . 8.7 m-85 -64.92 -33.96 77.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.303 -0.408 . . . . 2.23 111.214 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -71.58 -26.49 62.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.989 -0.551 . . . . 1.45 111.32 -179.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -87.26 -41.92 13.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.723 0.297 . . . . 1.32 110.542 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.442 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 35.0 p -67.3 -52.52 39.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.326 -0.397 . . . . 1.18 111.001 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.422 ' CE1' ' HA ' ' A' ' 40' ' ' ALA . 18.9 m-85 -74.31 -31.54 62.52 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.323 -0.398 . . . . 2.13 110.712 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -63.14 -43.64 98.37 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.166 -0.54 . . . . 0.34 113.39 -179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.442 ' HE2' ' HA ' ' A' ' 82' ' ' SER . 0.1 OUTLIER -65.47 -24.79 67.25 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.254 0.465 . . . . 1.9 112.254 -178.627 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.7 m -104.77 -9.86 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 C-N-CA 120.894 -0.322 . . . . 1.04 111.364 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.22 -48.73 80.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.267 -0.424 . . . . 1.09 111.432 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.04 -41.76 88.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.157 -0.474 . . . . 1.13 111.359 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -62.33 -50.31 72.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.888 -0.596 . . . . 1.56 110.464 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 92.9 t -65.32 -41.31 91.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.957 -0.565 . . . . 1.15 110.936 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -60.87 -48.29 82.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.501 -0.318 . . . . 2.15 111.101 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -64.9 -25.47 70.69 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.589 -0.815 . . . . 0.41 111.879 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.581 ' O ' ' HG2' ' A' ' 96' ' ' GLN . 3.8 mmm-85 -78.87 -51.75 9.26 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.435 0.16 . . . . 3.95 111.21 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 46.2 pt -68.09 -22.26 27.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.926 -0.31 . . . . 1.22 111.241 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -65.51 -28.06 68.92 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.927 0.394 . . . . 1.06 110.742 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.581 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 10.0 pt20 -98.49 -11.84 21.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.031 0.443 . . . . 1.57 110.767 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -91.43 -37.61 13.09 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.153 -0.476 . . . . 1.33 110.628 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -72.99 130.2 85.36 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.265 -0.425 . . . . 2.29 109.933 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -52.55 -77.1 0.02 OUTLIER 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 123.317 2.678 . . . . 1.47 113.298 -179.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -155.8 -53.94 0.09 Allowed 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 111.905 0.335 . . . . 5.56 111.905 179.478 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -65.24 -33.38 75.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.038 0.447 . . . . 2.58 110.838 -179.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 79.5 mt -74.13 -39.01 63.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.174 -0.466 . . . . 1.4 110.875 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . 0.478 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 10.6 ptpt -73.11 -8.75 57.14 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 121.336 0.589 . . . . 2.83 110.392 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -81.05 -10.76 59.64 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.361 -0.836 . . . . 2.98 109.539 178.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -95.26 -30.06 14.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.722 -0.672 . . . . 2.89 111.308 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 103' ' ' LYS . 4.2 pp -69.78 -28.27 65.62 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 121.056 0.455 . . . . 1.81 110.233 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.04 -34.57 76.71 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.979 -0.555 . . . . 1.53 110.126 179.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 108' ' ' ARG . 40.0 mmt180 -66.57 -51.62 54.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.556 -0.747 . . . . 4.16 111.051 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.439 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 2.7 p -65.28 -40.26 88.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.423 -0.353 . . . . 1.81 110.699 -179.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 6.3 t -62.5 -42.8 97.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.864 0.364 . . . . 1.68 110.046 179.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -59.26 -47.83 83.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.866 -0.607 . . . . 2.24 109.953 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.423 ' O ' ' HG2' ' A' ' 116' ' ' ARG . 96.8 mt -60.7 -49.72 83.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.996 -0.547 . . . . 1.8 111.335 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 96.0 mt -59.87 -39.15 84.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.331 -0.395 . . . . 1.98 111.963 -178.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 4.7 pttp -82.23 -22.93 35.63 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.549 -0.46 . . . . 2.17 111.769 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -78.79 -37.0 41.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.923 0.392 . . . . 2.2 110.48 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . 0.423 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 13.4 mmm-85 -84.67 1.37 46.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.083 -0.508 . . . . 3.8 110.288 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 11.5 m120 57.79 47.79 14.84 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.435 -0.802 . . . . 2.23 111.034 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 31.6 mm -70.17 -50.45 47.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.907 -0.588 . . . . 1.26 109.801 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -100.38 158.79 15.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.901 -0.591 . . . . 2.11 110.309 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.8 m -67.32 156.02 37.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.194 -0.457 . . . . 1.55 109.945 179.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 61.3 mtpt -55.77 -34.29 65.12 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.945 0.35 . . . . 3.34 111.945 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -59.54 -41.83 90.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.184 0.516 . . . . 3.37 110.02 179.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.43 ' O ' HG13 ' A' ' 127' ' ' ILE . 40.7 t -72.27 -45.01 62.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.578 -0.737 . . . . 1.92 110.301 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 76.8 t -57.87 -44.07 85.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.496 . . . . 1.92 110.932 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 42.4 t-20 -58.01 -45.76 86.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.923 -0.58 . . . . 2.18 110.259 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -62.96 -38.82 92.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.984 -0.553 . . . . 1.44 111.305 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 123' ' ' VAL . 79.9 mt -66.75 -46.67 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.091 0.472 . . . . 1.17 110.775 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 68.5 mt-10 -63.17 -28.86 70.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.151 -0.477 . . . . 2.05 110.952 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.441 HH11 ' HD3' ' A' ' 129' ' ' ARG . 21.5 mtm-85 -81.11 -41.08 23.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.24 -0.437 . . . . 4.63 111.984 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 1.2 p -62.71 -33.72 75.69 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.002 0.43 . . . . 0.93 110.654 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.6 mp -68.5 -44.25 75.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.169 -0.469 . . . . 2.04 110.401 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.84 -37.83 76.29 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.044 -0.526 . . . . 1.22 111.735 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.42 ' O ' ' HG2' ' A' ' 136' ' ' GLU . . . -64.44 -19.43 65.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.936 0.398 . . . . 1.45 111.426 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -85.14 -5.94 59.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.109 -0.496 . . . . 1.28 111.281 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.7 pp -132.13 19.09 4.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.857 0.361 . . . . 4.46 111.318 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 133' ' ' ALA . 4.4 pt-20 -81.45 -27.82 34.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.147 0.498 . . . . 6.64 110.175 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 20.8 t-80 . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.506 -0.759 . . . . 8.81 110.15 179.95 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 206' ' ' PRO . . . . . 0.501 ' HD2' ' OG ' ' A' ' 18' ' ' SER . 12.2 Cg_exo . . . . . 0 C--O 1.235 0.326 0 CA-C-O 120.722 0.218 . . . . 7.93 111.721 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 3.7 m 59.59 82.88 0.14 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.016 -0.538 . . . . 6.33 112.274 178.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . 0.504 ' HH ' ' CD2' ' A' ' 66' ' ' HIS . 89.8 t80 -78.8 130.1 35.34 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 122.226 -0.296 . . . . 4.66 110.34 179.259 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 209' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -60.35 -27.32 84.64 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.536 2.157 . . . . 4.88 112.235 179.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.62 3.16 38.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.98 -0.555 . . . . 5.34 111.006 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 16.8 m -149.1 83.73 6.55 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 116.399 -0.364 . . . . 3.29 110.559 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 213' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -69.76 -12.48 32.99 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.469 2.113 . . . . 4.56 112.097 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.102 0 CA-C-N 115.615 -0.721 . . . . 6.05 110.319 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.877 0 CA-C-O 120.635 0.255 . . . . 5.77 110.586 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -113.46 -7.33 13.44 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.245 0.545 . . . . 6.18 110.362 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.2 m -79.15 79.23 5.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.915 -0.584 . . . . 3.04 111.085 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.435 ' O ' ' HG2' ' A' ' 6' ' ' GLU . 1.0 OUTLIER -71.58 108.22 4.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.926 -0.579 . . . . 3.56 110.454 179.692 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.485 ' HA ' ' SD ' ' A' ' 42' ' ' MET . 0.5 OUTLIER 36.12 50.4 0.7 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.182 0.993 . . . . 2.9 112.659 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.519 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 19.8 mm100 -69.4 -17.37 63.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.056 -0.52 . . . . 3.17 110.644 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.504 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 78.5 t80 -79.93 -42.58 23.77 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.923 -0.581 . . . . 1.44 109.693 179.114 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.1 m -65.34 -34.54 78.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.65 -0.705 . . . . 1.38 111.494 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.07 -35.53 81.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.003 0.43 . . . . 1.95 110.719 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 31.1 mmmt -76.23 -38.81 55.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.056 -0.52 . . . . 1.78 110.584 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -60.97 -29.03 69.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.25 -0.432 . . . . 2.19 111.499 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 -83.76 -5.97 59.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.309 -0.405 . . . . 1.96 111.855 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.462 HG21 ' O ' ' A' ' 11' ' ' LYS . 3.6 t -115.81 -3.27 12.23 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.669 -0.412 . . . . 2.11 111.44 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 32.5 mt -72.93 163.07 28.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.52 -0.309 . . . . 1.63 111.03 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -143.67 -170.26 3.26 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.708 -0.479 . . . . 2.16 109.708 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' B' ' 208' ' ' TYR . 1.1 t70 -76.67 -19.28 57.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.198 0.523 . . . . 1.94 110.379 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.506 ' HA ' ' CB ' ' B' ' 206' ' ' PRO . 0.0 OUTLIER -54.56 116.88 2.91 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.587 -0.733 . . . . 1.89 110.782 179.754 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.458 ' OE1' ' HA ' ' B' ' 208' ' ' TYR . 0.2 OUTLIER -55.47 -35.22 65.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.769 -0.651 . . . . 3.13 110.784 -179.485 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -65.7 -34.09 77.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.853 -0.612 . . . . 2.99 110.967 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.5 p -71.41 -40.11 70.69 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.575 -0.528 . . . . 1.62 109.575 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.1 mm -66.59 -44.18 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 CA-C-N 115.91 -0.587 . . . . 1.52 109.77 179.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 56.0 m -59.58 -38.01 80.02 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.971 -0.559 . . . . 1.63 111.173 179.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.3 m -67.9 -28.69 67.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.809 0.338 . . . . 1.4 110.832 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.78 -44.26 15.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.255 -0.43 . . . . 1.14 111.113 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.4 p -62.44 -44.01 97.45 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.726 0.298 . . . . 1.62 110.651 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -64.66 -36.96 85.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.982 0.42 . . . . 2.76 110.536 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -67.44 -36.16 80.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.267 0.556 . . . . 1.14 109.539 178.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -70.86 -39.41 72.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.715 -0.675 . . . . 1.91 110.559 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.0 mt -62.28 -24.91 67.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.303 -0.408 . . . . 1.71 110.739 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 24.0 mt -78.55 -16.38 57.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.99 -0.55 . . . . 2.2 111.338 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -120.58 46.5 1.98 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.075 0.464 . . . . 1.53 110.659 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -62.81 -9.69 10.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 2.35 111.386 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 77.5 mtt180 -66.28 -35.42 80.34 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.218 0.532 . . . . 4.54 110.088 178.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -103.79 27.63 7.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.617 -0.719 . . . . 1.7 110.86 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.466 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.51 -51.32 74.15 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.736 -0.665 . . . . 1.06 111.852 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 33.4 Cg_endo -64.5 -28.64 61.92 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 121.617 1.544 . . . . 0.62 112.089 179.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.1 tppt? -72.77 -46.27 54.27 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.023 -0.535 . . . . 3.25 111.185 -179.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 35.5 m -72.19 -25.23 23.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 C-N-CA 120.924 -0.311 . . . . 1.12 110.521 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.01 -49.2 62.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 0.99 110.494 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -68.91 -33.87 74.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.986 -0.552 . . . . 1.4 110.098 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.504 ' SD ' ' HB3' ' A' ' 8' ' ' PHE . 39.2 ttm -66.41 -40.05 89.34 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.935 -0.575 . . . . 2.13 109.916 179.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 51.5 t90 -62.48 -47.33 84.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.493 -0.776 . . . . 0.47 109.566 178.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 38.9 tttt -56.62 -47.71 79.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.384 -0.826 . . . . 1.71 110.802 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' A' ' 49' ' ' ARG . 12.4 mm-40 -57.95 -44.68 87.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.044 -0.526 . . . . 1.96 111.304 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -66.18 -44.46 83.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 2.37 111.353 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 84.8 mmm -66.32 -29.62 69.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.303 -0.408 . . . . 1.15 111.577 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.2 mt -92.73 19.4 7.55 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.796 0.331 . . . . 1.39 111.365 -179.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.574 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 36.1 mmt-85 -87.08 133.88 38.04 Favored Pre-proline 0 C--N 1.328 -0.353 0 N-CA-C 110.011 -0.366 . . . . 3.14 110.011 178.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -74.34 -22.34 16.47 Favored 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.51 2.14 . . . . 1.07 112.397 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.3 m -83.3 -16.18 47.23 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.244 -0.435 . . . . 1.64 111.456 -179.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.6 t -77.76 127.36 38.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.122 0.486 . . . . 1.17 110.794 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -66.55 149.13 50.91 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.437 -0.801 . . . . 2.2 111.137 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.48 -39.46 70.43 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.097 0.406 . . . . 1.52 112.097 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 42.0 mtm105 -67.82 -29.73 68.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.877 0.37 . . . . 4.09 110.682 -179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -69.3 -36.67 77.26 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.642 -0.503 . . . . 3.61 109.642 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 50.8 mttt -70.03 -33.15 71.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.695 -0.684 . . . . 1.15 109.291 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 19.9 tp -62.66 -41.01 98.83 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.667 -0.697 . . . . 1.87 109.811 178.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.9 mp -67.64 -36.99 81.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.468 -0.787 . . . . 2.11 109.997 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.17 -30.19 75.36 Favored Glycine 0 C--N 1.331 0.293 0 CA-C-N 115.802 -0.635 . . . . 0.4 111.604 179.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 8.3 mt -63.84 -44.63 92.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.882 0.372 . . . . 1.88 110.216 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -62.56 -39.22 92.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.672 -0.695 . . . . 2.18 110.548 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -61.25 -48.87 79.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.94 -0.573 . . . . 2.19 110.618 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.444 ' O ' HG13 ' A' ' 67' ' ' VAL . 14.7 tmm? -62.38 -48.56 79.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 1.17 110.295 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -58.5 -41.59 85.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.794 -0.639 . . . . 2.22 111.382 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -68.03 -47.72 67.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.157 -0.474 . . . . 2.15 111.612 -179.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.444 HG13 ' O ' ' A' ' 64' ' ' MET . 8.2 p -64.28 -36.29 76.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 112.645 0.609 . . . . 2.07 112.645 -177.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.406 HG21 ' O ' ' A' ' 64' ' ' MET . 35.7 m -78.27 -26.07 14.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 C-N-CA 120.726 -0.39 . . . . 1.18 111.28 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -52.07 20.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.018 0.437 . . . . 2.59 109.848 179.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 26.6 mm100 -72.27 -15.21 61.91 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.058 -0.519 . . . . 2.55 110.925 -179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.79 -25.68 68.02 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.261 -0.427 . . . . 1.16 110.56 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.488 ' HG2' ' NE2' ' A' ' 80' ' ' GLN . 19.5 mtpt -70.63 -21.04 62.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.335 -0.393 . . . . 2.55 110.443 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.21 -43.69 31.44 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.967 -0.635 . . . . 0.66 112.177 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -91.47 -0.85 57.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.742 0.306 . . . . 1.91 110.616 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp 62.98 46.09 4.99 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.429 -0.805 . . . . 3.18 111.132 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 31.9 mm -95.89 78.7 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.921 -0.582 . . . . 1.2 110.124 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.559 ' HA ' ' OE1' ' A' ' 80' ' ' GLN . 15.4 pt -68.51 -16.3 20.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.713 -0.676 . . . . 1.4 110.295 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -61.48 -37.9 85.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.542 -0.754 . . . . 2.37 110.541 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.425 ' O ' ' HB2' ' A' ' 83' ' ' PHE . 0.8 OUTLIER -72.42 -42.13 65.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.017 -0.538 . . . . 2.23 111.173 -179.406 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.559 ' OE1' ' HA ' ' A' ' 77' ' ' ILE . 21.6 mt-30 -68.94 -27.47 65.77 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.081 -0.509 . . . . 1.45 111.511 -178.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.558 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 5.6 t70 -76.02 -49.21 18.23 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.97 0.415 . . . . 1.32 110.125 178.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.7 p -67.64 -49.15 64.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.022 -0.535 . . . . 1.18 111.516 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.425 ' HB2' ' O ' ' A' ' 79' ' ' PHE . 4.4 m-85 -71.36 -30.7 66.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.59 -0.277 . . . . 2.13 111.239 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.85 -52.03 54.93 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.107 -0.568 . . . . 0.34 113.785 -179.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.558 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 10.0 ptpt -60.26 -36.67 78.32 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.072 0.397 . . . . 1.9 112.072 -178.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.8 m -82.8 -28.01 8.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 C-N-CA 120.667 -0.413 . . . . 1.04 111.124 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 91' ' ' LEU . . . -62.14 -41.2 98.03 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.639 -0.255 . . . . 1.09 110.934 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.09 -33.9 69.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.028 0.442 . . . . 1.13 111.125 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -83.39 -52.46 6.51 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.909 -0.587 . . . . 1.56 110.873 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.5 ' O ' HG12 ' A' ' 94' ' ' ILE . 75.7 t -57.56 -50.83 75.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.093 -0.503 . . . . 1.15 111.997 -178.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.414 ' HB2' ' O ' ' A' ' 87' ' ' ALA . 8.5 mp -61.52 -38.52 87.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.692 -0.231 . . . . 2.15 111.087 -178.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -70.88 -28.82 70.02 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.506 -0.854 . . . . 0.41 112.005 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.521 ' O ' ' HG2' ' A' ' 96' ' ' GLN . 1.3 mmm-85 -78.02 -51.45 10.32 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.646 0.26 . . . . 3.95 111.063 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.5 HG12 ' O ' ' A' ' 90' ' ' VAL . 32.8 pt -70.78 -15.85 19.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.523 -0.308 . . . . 1.22 111.615 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -58.19 -34.16 70.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.018 0.437 . . . . 1.06 110.675 179.301 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 4.3 pt20 -96.56 1.74 51.64 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.155 -0.475 . . . . 1.57 110.799 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -100.67 -31.23 11.32 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.15 0.5 . . . . 1.33 109.965 179.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -81.67 131.76 56.82 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.518 -0.765 . . . . 2.29 111.11 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -65.1 167.6 15.8 Favored 'Trans proline' 0 CA--C 1.529 0.271 0 C-N-CA 122.699 2.266 . . . . 1.47 111.724 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 13.3 mmm180 -47.82 -40.57 21.51 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.852 0.686 . . . . 5.56 112.852 -179.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -71.53 -47.81 52.76 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.002 0.371 . . . . 2.58 112.002 -179.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 30.7 mt -70.94 -39.59 72.54 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.857 0.317 . . . . 1.4 111.857 -178.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -71.15 -17.73 62.54 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.766 -0.374 . . . . 2.83 110.629 -179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -67.22 -34.38 77.35 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.182 -1.044 . . . . 2.98 108.182 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.4 ' O ' HG22 ' A' ' 109' ' ' VAL . 74.0 mmtt -76.49 -37.05 57.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.178 -0.919 . . . . 2.89 109.064 178.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 35.4 tp -59.58 -37.58 78.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.549 -0.75 . . . . 1.81 109.974 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.54 ' O ' ' HB2' ' A' ' 111' ' ' ASN . 36.7 m -61.04 -37.48 82.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.619 -0.719 . . . . 1.53 110.328 179.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.9 mtt180 -70.24 -38.19 75.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 4.16 110.555 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.431 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 61.8 t -60.9 -57.2 13.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.039 -0.528 . . . . 1.81 110.719 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 10.8 p -65.18 -28.97 45.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.182 -0.463 . . . . 1.68 111.054 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . 0.54 ' HB2' ' O ' ' A' ' 107' ' ' SER . 56.0 t30 -60.33 -55.71 30.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.248 -0.433 . . . . 2.24 110.307 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 95.7 mt -62.95 -36.19 74.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.092 -0.504 . . . . 1.8 111.154 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 71.5 mt -56.36 -42.8 78.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.363 -0.38 . . . . 1.98 111.764 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.78 -29.32 19.86 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.816 -0.353 . . . . 2.17 111.372 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -65.57 -38.55 89.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.764 0.316 . . . . 2.2 111.561 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 7.9 mmm180 -96.11 5.61 50.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.347 -0.388 . . . . 3.8 111.012 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.0 m120 52.22 57.75 6.13 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.391 0.615 . . . . 2.23 110.901 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 43.2 mm -76.13 -33.63 24.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.552 -0.749 . . . . 1.26 110.286 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -110.47 171.91 7.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.776 -0.647 . . . . 2.11 110.811 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.0 t -69.65 146.98 51.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.744 -0.662 . . . . 1.55 109.932 179.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 50.7 pttt -59.47 -27.48 66.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.759 0.281 . . . . 3.34 111.759 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -68.78 -44.23 74.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.842 0.353 . . . . 3.37 110.817 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.536 ' O ' HG13 ' A' ' 127' ' ' ILE . 9.1 p -82.47 -28.42 8.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.416 -0.356 . . . . 1.92 110.912 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 7.3 t -61.26 -43.22 96.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 109.633 -0.506 . . . . 1.92 109.633 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -64.7 -35.43 81.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.674 -0.694 . . . . 2.18 109.963 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -63.57 -41.26 98.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.872 -0.604 . . . . 1.44 110.219 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 123' ' ' VAL . 63.6 mt -62.73 -53.99 39.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.799 -0.637 . . . . 1.17 111.334 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -63.55 -36.54 84.12 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 120.994 -0.282 . . . . 2.05 111.08 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -61.98 -39.74 93.22 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.847 -0.427 . . . . 4.63 109.847 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 44.6 m -67.53 -39.77 85.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.916 -0.583 . . . . 0.93 110.493 179.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.0 mt -69.16 -29.45 67.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.094 -0.503 . . . . 2.04 110.927 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -78.78 -37.79 40.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.197 -0.456 . . . . 1.22 110.503 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.02 -19.26 62.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.829 -0.623 . . . . 1.45 111.782 -179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.13 -44.87 96.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.432 -0.349 . . . . 1.28 111.072 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 68.9 mt 55.47 45.21 25.62 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.989 -0.55 . . . . 4.46 112.078 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.21 3.19 27.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.045 0.45 . . . . 6.64 110.687 179.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.53 -0.747 . . . . 8.81 110.589 -179.605 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 206' ' ' PRO . . . . . 0.506 ' CB ' ' HA ' ' A' ' 18' ' ' SER . 2.8 Cg_exo . . . . . 0 CA--C 1.53 0.323 0 N-CA-C 111.634 -0.179 . . . . 7.93 111.634 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 3.2 m 59.64 81.1 0.18 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.189 0.519 . . . . 6.33 111.242 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . 0.458 ' HA ' ' OE1' ' A' ' 19' ' ' GLN . 3.4 t80 -65.27 113.4 4.0 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.973 -0.454 . . . . 4.66 110.471 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 209' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.59 -30.4 65.25 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.791 2.327 . . . . 4.88 112.757 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.17 -7.12 58.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.026 0.441 . . . . 5.34 110.977 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 9.0 m -139.5 72.55 37.01 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.523 -0.308 . . . . 3.29 110.522 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 213' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -76.21 -59.67 0.04 OUTLIER 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.887 2.392 . . . . 4.56 111.985 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.191 0 CA-C-O 118.56 -0.733 . . . . 6.05 110.136 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.963 0 CA-C-O 120.804 0.335 . . . . 5.77 110.724 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -102.78 162.56 12.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.351 -0.386 . . . . 6.18 110.428 179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -75.92 94.51 3.38 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.178 -0.465 . . . . 3.04 111.483 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -81.79 148.07 29.07 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.157 -0.474 . . . . 3.56 110.471 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.444 ' HG3' ' HB ' ' A' ' 9' ' ' THR . 0.0 OUTLIER 60.9 37.72 18.22 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 123.373 0.421 . . . . 2.9 111.693 179.186 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -56.46 -61.12 2.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.283 -0.417 . . . . 3.17 111.724 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -68.54 -42.56 78.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.05 0.452 . . . . 1.44 111.206 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.444 ' HB ' ' HG3' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -59.92 -42.49 94.04 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.964 0.727 . . . . 1.38 112.964 -178.57 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.11 -21.92 61.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.61 0.243 . . . . 1.95 111.385 -179.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -69.49 -36.74 76.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.74 0.305 . . . . 1.78 110.42 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -64.97 -28.88 69.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.236 0.541 . . . . 2.19 110.708 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -78.9 -10.59 59.86 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.673 -0.694 . . . . 1.96 110.919 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.59 36.28 4.64 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.171 0.51 . . . . 2.11 111.155 -179.529 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.9 mt -112.36 163.2 14.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.051 0.453 . . . . 1.63 111.286 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -134.06 160.77 36.76 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.571 -0.74 . . . . 2.16 109.133 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -79.82 29.31 0.26 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.777 0.323 . . . . 1.94 111.701 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.569 ' OG ' ' HB3' ' B' ' 206' ' ' PRO . 68.6 m -93.32 140.95 28.99 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.179 -0.304 . . . . 1.89 110.179 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.622 ' OE1' ' HA ' ' B' ' 208' ' ' TYR . 0.4 OUTLIER -56.49 -52.86 63.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.121 -0.491 . . . . 3.13 110.333 -179.342 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -61.48 -40.77 95.76 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.908 -0.587 . . . . 2.99 111.775 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.518 ' OG ' ' HB2' ' A' ' 18' ' ' SER . 18.1 m -59.25 -49.1 79.13 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.765 0.316 . . . . 1.62 110.968 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.1 mm -64.1 -41.91 93.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.726 -0.472 . . . . 1.52 109.726 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.6 m -59.04 -40.88 86.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.928 -0.578 . . . . 1.63 111.01 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.3 m -61.26 -47.16 87.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 1.4 110.825 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.38 -42.0 79.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.347 -0.388 . . . . 1.14 111.052 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 19.1 m -62.7 -36.64 83.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.28 -0.418 . . . . 1.62 111.244 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.9 ttpt -61.24 -40.91 95.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.811 0.339 . . . . 2.76 110.532 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 33.1 t90 -68.59 -38.24 80.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.955 0.407 . . . . 1.14 109.916 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -64.12 -41.06 97.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.796 -0.638 . . . . 1.91 110.756 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.66 -33.24 73.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.119 -0.491 . . . . 1.71 110.732 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 74.8 mt -73.04 -25.18 60.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.968 -0.56 . . . . 2.2 110.308 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 70.9 mm-40 -97.93 48.42 1.01 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.044 -0.525 . . . . 1.53 110.613 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.448 ' HA ' ' CZ ' ' A' ' 79' ' ' PHE . 6.6 p90 -59.71 -21.31 60.44 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.681 -0.69 . . . . 2.35 111.614 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -75.64 -14.77 60.38 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.28 -0.418 . . . . 4.54 111.363 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -109.44 12.72 24.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.778 0.323 . . . . 1.7 110.899 -179.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.448 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -51.45 -51.02 73.17 Favored Pre-proline 0 CA--C 1.538 0.483 0 CA-C-N 115.903 -0.59 . . . . 1.06 112.414 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.448 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 39.3 Cg_endo -66.07 -19.92 57.19 Favored 'Trans proline' 0 C--N 1.357 0.978 0 C-N-CA 121.888 1.725 . . . . 0.62 112.831 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.7 tptm -88.28 -46.26 9.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.672 0.272 . . . . 3.25 110.821 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.2 m -67.44 -28.36 41.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.964 -0.294 . . . . 1.12 110.854 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.98 -46.77 80.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.362 -0.381 . . . . 0.99 111.337 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -70.41 -38.09 74.56 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.891 -0.324 . . . . 1.4 110.454 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 68.8 mtm -63.12 -41.91 99.42 Favored 'General case' 0 CA--C 1.521 -0.168 0 N-CA-C 109.98 -0.378 . . . . 2.13 109.98 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 71.1 t90 -61.95 -48.57 79.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.616 -0.72 . . . . 0.47 110.256 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.496 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 16.1 ttpt -58.71 -49.51 77.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.807 -0.633 . . . . 1.71 110.65 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.485 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 57.7 mm-40 -60.85 -42.3 97.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.886 -0.597 . . . . 1.96 111.087 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 76.3 t80 -62.65 -47.7 82.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.104 -0.498 . . . . 2.37 111.109 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.444 ' HE2' ' O ' ' A' ' 57' ' ' LYS . 74.6 mmm -64.55 -20.8 66.45 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.26 -0.427 . . . . 1.15 111.988 -179.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 64.0 mt -97.63 0.12 46.67 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.626 0.232 . . . . 1.39 111.626 -179.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 27.0 mtp180 -79.03 135.64 58.42 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.628 0.251 . . . . 3.14 110.528 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.12 5.95 3.28 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.909 2.406 . . . . 1.07 112.81 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.1 m -103.22 8.23 38.46 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.097 -0.501 . . . . 1.64 110.347 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.5 t -111.54 123.6 67.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.984 -0.553 . . . . 1.17 111.065 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -73.3 153.7 40.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.0 -0.545 . . . . 2.2 110.641 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.09 -32.56 62.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 1.52 112.193 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -42.37 98.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.875 0.369 . . . . 4.09 110.79 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.9 mtm-85 -71.57 -29.8 65.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.246 -0.434 . . . . 3.61 110.617 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.444 ' O ' ' HE2' ' A' ' 47' ' ' MET . 54.2 mttt -65.28 -34.43 78.33 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.334 -0.617 . . . . 1.15 109.334 178.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 21.4 tp -67.53 -41.25 84.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.803 -0.635 . . . . 1.87 109.315 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.7 mp -63.75 -44.83 92.32 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.291 -0.868 . . . . 2.11 110.032 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.16 -35.39 91.46 Favored Glycine 0 C--N 1.333 0.383 0 CA-C-N 115.845 -0.616 . . . . 0.4 111.949 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.36 -44.31 91.82 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.666 -0.494 . . . . 1.88 109.666 179.011 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -65.81 -34.47 78.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.801 -0.636 . . . . 2.18 111.114 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 39.3 tp -63.84 -44.14 94.07 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.76 -0.459 . . . . 2.19 109.76 178.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.434 ' O ' HG23 ' A' ' 68' ' ' VAL . 15.8 tmm? -64.97 -44.32 89.77 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.688 -0.687 . . . . 1.17 109.897 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -57.67 -39.7 77.68 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.817 -0.628 . . . . 2.22 110.999 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -67.04 -52.73 38.62 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.081 -0.509 . . . . 2.15 111.44 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 31.5 m -63.18 -34.89 69.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 112.817 0.673 . . . . 2.07 112.817 -178.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 64' ' ' MET . 34.6 m -78.5 -24.77 13.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 C-N-CA 120.276 -0.57 . . . . 1.18 110.969 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -76.74 -45.81 27.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.155 0.502 . . . . 2.59 109.953 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -75.29 -16.36 60.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.617 -0.719 . . . . 2.55 110.819 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.47 -33.99 73.38 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 116.06 -0.518 . . . . 1.16 110.682 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.489 ' HG2' HE22 ' A' ' 80' ' ' GLN . 1.8 mmtp -68.35 -27.32 66.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 2.55 110.347 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.01 -46.37 73.77 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.932 -0.576 . . . . 0.66 111.801 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -87.38 -6.56 58.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.981 0.42 . . . . 1.91 110.352 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.88 27.17 9.09 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.25 -0.886 . . . . 3.18 111.668 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.7 mm -94.44 87.71 2.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 109.343 -0.614 . . . . 1.2 109.343 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 18.2 pt -72.33 -8.8 12.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.901 -0.59 . . . . 1.4 111.796 -178.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -60.16 -33.38 72.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.918 0.389 . . . . 2.37 110.388 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.448 ' CZ ' ' HA ' ' A' ' 33' ' ' TYR . 29.7 m-85 -69.04 -48.72 62.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.873 -0.603 . . . . 2.23 109.615 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.489 HE22 ' HG2' ' A' ' 72' ' ' LYS . 86.0 mt-30 -65.19 -32.13 73.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.301 -0.863 . . . . 1.45 111.553 -179.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.495 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 9.5 t70 -72.74 -53.64 11.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.834 0.349 . . . . 1.32 110.406 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.4 m -63.65 -42.58 98.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.062 -0.517 . . . . 1.18 111.774 -179.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -78.35 -29.19 47.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.616 -0.265 . . . . 2.13 110.977 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -64.95 -41.65 97.26 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 121.049 -0.596 . . . . 0.34 113.346 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.495 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 12.8 ptpt -68.82 -18.34 64.15 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.042 0.386 . . . . 1.9 112.042 -178.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 32.6 m -107.95 -19.91 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 121.008 -0.277 . . . . 1.04 111.222 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.13 95.6 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.431 -0.35 . . . . 1.09 110.96 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.73 -44.2 73.33 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.077 -0.511 . . . . 1.13 110.624 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.4 tp10 -63.68 -58.72 6.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.601 -0.727 . . . . 1.56 110.208 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.48 ' O ' HG12 ' A' ' 94' ' ' ILE . 80.7 t -54.03 -50.27 55.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.761 -0.654 . . . . 1.15 111.994 -179.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 81.7 mt -60.97 -42.5 98.42 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.641 0.237 . . . . 2.15 111.641 -179.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -67.86 -25.02 74.33 Favored Glycine 0 CA--C 1.519 0.318 0 C-N-CA 120.718 -0.753 . . . . 0.41 112.241 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 33.5 mmm-85 -83.31 -55.05 4.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.641 0.258 . . . . 3.95 111.213 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 90' ' ' VAL . 30.6 pt -66.38 -19.8 26.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 112.359 0.503 . . . . 1.22 112.359 -178.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.1 t30 -63.45 -24.27 67.76 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.256 0.551 . . . . 1.06 110.31 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -90.74 -14.1 32.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.058 -0.519 . . . . 1.57 110.73 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -101.91 -28.69 12.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.03 -0.532 . . . . 1.33 111.048 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -70.26 121.76 84.21 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.166 -0.47 . . . . 2.29 111.411 -179.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -68.64 175.91 6.54 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.417 2.078 . . . . 1.47 111.822 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.439 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 13.5 ptt-85 -53.02 -27.67 20.53 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.052 -0.522 . . . . 5.56 112.106 -179.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -76.37 -48.42 19.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.028 0.442 . . . . 2.58 111.776 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 22.3 mt -76.7 -35.36 57.93 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.737 0.643 . . . . 1.4 112.737 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 6.0 pttp -64.89 -25.22 67.8 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.733 -0.387 . . . . 2.83 110.993 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 100' ' ' ARG . 47.6 mtmt -66.31 -37.74 86.08 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.221 -0.659 . . . . 2.98 109.221 178.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -75.68 -34.26 60.42 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.162 -0.926 . . . . 2.89 109.798 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 7.0 tt -63.79 -41.99 97.82 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.417 -0.81 . . . . 1.81 109.985 178.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 21.0 m -62.58 -32.5 73.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.126 -0.488 . . . . 1.53 110.611 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 70.6 mtt180 -67.17 -55.43 14.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.028 -0.533 . . . . 4.16 111.286 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 7.7 p -62.48 -42.5 95.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.307 -0.406 . . . . 1.81 111.983 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.72 -40.56 82.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 120.836 0.35 . . . . 1.68 110.555 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . 0.441 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 11.9 t-20 -61.28 -48.56 80.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.867 -0.606 . . . . 2.24 110.637 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 63.3 mt -61.12 -46.71 96.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.281 -0.418 . . . . 1.8 111.347 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 96.3 mt -59.12 -42.49 90.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.094 -0.503 . . . . 1.98 112.291 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 111' ' ' ASN . 1.2 ptpt -78.48 -33.31 48.31 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.054 0.39 . . . . 2.17 112.054 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -75.62 -39.2 58.19 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.906 0.336 . . . . 2.2 111.906 -178.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -79.96 -1.15 38.24 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.033 0.444 . . . . 3.8 110.801 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 60.8 50.76 5.18 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.589 -0.732 . . . . 2.23 111.454 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 45.9 mm -72.47 -40.6 63.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.091 0.472 . . . . 1.26 110.235 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -109.52 173.85 6.13 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.938 -0.574 . . . . 2.11 109.835 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.78 162.69 29.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.175 -0.466 . . . . 1.55 110.863 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 15.2 mmmt -52.74 -50.27 63.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.17 -0.468 . . . . 3.34 111.292 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -56.37 -34.45 66.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.843 -0.617 . . . . 3.37 112.072 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 61.6 t -80.14 -49.58 18.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.793 0.294 . . . . 1.92 111.793 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 34.7 m -62.63 -29.74 47.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 C-N-CA 120.964 -0.294 . . . . 1.92 111.159 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -78.92 -27.16 43.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.931 0.395 . . . . 2.18 110.819 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.459 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 44.8 t0 -76.63 -41.25 46.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.267 0.556 . . . . 1.44 109.959 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 96.3 mt -60.08 -50.97 78.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.826 -0.624 . . . . 1.17 111.42 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -65.65 -37.39 86.41 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.123 0.416 . . . . 2.05 112.123 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 33.2 ptt180 -69.63 -26.03 64.22 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 120.761 -0.376 . . . . 4.63 110.785 -179.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 49.3 m -68.36 -39.18 81.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.294 0.568 . . . . 0.93 109.684 178.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.8 mp -67.39 -41.93 84.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.735 -0.666 . . . . 2.04 110.123 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.06 -34.9 77.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.795 -0.638 . . . . 1.22 111.043 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -73.14 -25.08 60.69 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.825 0.345 . . . . 1.45 111.086 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -78.32 -23.44 47.04 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.513 -0.312 . . . . 1.28 110.992 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 54.3 mt 58.07 31.8 21.16 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.778 -0.646 . . . . 4.46 111.124 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -95.49 7.05 47.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.339 0.59 . . . . 6.64 110.682 -179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.587 -0.721 . . . . 8.81 110.065 -179.773 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 206' ' ' PRO . . . . . 0.569 ' HB3' ' OG ' ' A' ' 18' ' ' SER . 3.8 Cg_exo . . . . . 0 N--CA 1.476 0.488 0 N-CA-C 111.201 -0.346 . . . . 7.93 111.201 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 18.4 m 59.5 83.26 0.13 Allowed 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.489 0.661 . . . . 6.33 111.78 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . 0.622 ' HA ' ' OE1' ' A' ' 19' ' ' GLN . 7.4 t80 -71.89 133.08 45.21 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.681 -0.69 . . . . 4.66 110.196 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 209' ' ' SEP . . . . . 0.49 ' HB3' ' OG ' ' B' ' 212' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -55.91 -32.89 87.12 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.988 2.459 . . . . 4.88 114.012 -178.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -88.15 0.36 56.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.921 0.391 . . . . 5.34 111.35 -179.102 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 212' ' ' SER . . . . . 0.49 ' OG ' ' HB3' ' B' ' 209' ' ' SEP . 0.1 OUTLIER -140.29 79.89 20.5 Favored Pre-proline 0 C--O 1.235 0.34 0 CA-C-N 116.39 -0.368 . . . . 3.29 110.252 179.292 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 213' ' ' PRO . . . . . 0.474 ' HA ' ' CZ ' ' B' ' 208' ' ' TYR . 73.3 Cg_endo -75.49 -30.7 6.24 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.836 2.357 . . . . 4.56 112.955 -179.467 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 8.9 m . . . . . 0 C--O 1.248 0.991 0 CA-C-O 117.781 -1.104 . . . . 6.05 109.041 -179.789 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 120.719 0.295 . . . . 5.77 110.681 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -121.29 151.16 40.37 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.864 -0.421 . . . . 6.18 109.864 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.0 m -64.53 111.41 2.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.037 0.446 . . . . 3.04 110.602 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 m -88.28 135.78 33.29 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.912 -0.586 . . . . 3.56 111.536 -179.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 53.07 58.36 5.39 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.39 -0.823 . . . . 2.9 112.248 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.579 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 48.8 mt-30 -65.76 -34.73 78.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.746 -0.661 . . . . 3.17 110.08 179.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.561 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 70.3 t80 -59.11 -48.97 79.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.73 -0.668 . . . . 1.44 110.508 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.0 -39.08 88.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.889 -0.596 . . . . 1.38 111.039 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -64.99 -32.49 74.24 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 115.889 -0.596 . . . . 1.95 111.197 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.579 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 27.6 mmmt -76.49 -40.72 49.45 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 121.065 -0.254 . . . . 1.78 110.589 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.15 -39.78 91.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.067 -0.515 . . . . 2.19 111.381 -179.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -76.11 -1.96 28.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.425 -0.352 . . . . 1.96 111.599 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.7 m -126.93 32.39 5.12 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.586 0.708 . . . . 2.11 110.155 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 14.6 mt -111.75 168.1 9.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.683 -0.69 . . . . 1.63 111.162 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.529 ' HG2' ' H ' ' A' ' 17' ' ' ASP . 11.1 tt0 -137.9 173.72 11.33 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.551 -0.907 . . . . 2.16 108.551 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.529 ' H ' ' HG2' ' A' ' 16' ' ' GLU . 4.6 p30 -79.78 16.43 1.14 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.768 0.318 . . . . 1.94 111.665 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.4 ' OG ' ' HB3' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -82.07 132.67 35.25 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.832 -0.433 . . . . 1.89 109.832 178.885 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.457 ' HG2' ' N ' ' A' ' 20' ' ' GLU . 16.5 pm0 -62.94 -39.21 93.93 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.019 0.377 . . . . 3.13 112.019 -178.33 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.457 ' N ' ' HG2' ' A' ' 19' ' ' GLN . 5.9 tp10 -71.31 -25.62 62.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.995 0.426 . . . . 2.99 110.152 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 66.8 m -71.21 -44.32 65.63 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.9 -0.778 . . . . 1.62 108.9 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.2 mm -65.29 -45.09 94.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 108.69 -0.856 . . . . 1.52 108.69 178.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.8 t -54.86 -43.81 73.42 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.208 -0.905 . . . . 1.63 110.884 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.8 t -58.45 -43.51 88.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 1.4 110.857 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.9 -45.15 59.78 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.266 -0.424 . . . . 1.14 110.989 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.403 ' HG ' ' CG ' ' A' ' 66' ' ' HIS . 34.4 m -59.8 -40.65 89.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.325 -0.398 . . . . 1.62 111.306 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.56 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 8.2 mptt -56.97 -43.97 82.15 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.085 0.469 . . . . 2.76 110.273 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 24.2 t90 -68.93 -36.68 78.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.674 -0.694 . . . . 1.14 110.454 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -66.85 -43.64 83.1 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.193 -0.458 . . . . 1.91 110.91 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.4 mt -60.3 -27.41 67.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.071 -0.513 . . . . 1.71 111.793 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 77.8 mt -68.37 -39.09 81.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.934 0.397 . . . . 2.2 111.109 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -95.28 56.77 1.92 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.454 0.645 . . . . 1.53 110.716 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.407 ' HA ' ' CE2' ' A' ' 79' ' ' PHE . 36.5 p90 -64.51 -17.24 63.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.476 -0.784 . . . . 2.35 111.557 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 34' ' ' ARG . 9.3 ttp180 -79.9 -3.7 49.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.831 0.348 . . . . 4.54 111.229 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.45 22.18 12.23 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.073 0.463 . . . . 1.7 110.05 179.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.45 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.05 -51.75 68.39 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.253 -0.885 . . . . 1.06 112.274 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 24.1 Cg_endo -62.77 -33.06 77.58 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 121.721 1.614 . . . . 0.62 112.521 179.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -46.73 72.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.334 -0.394 . . . . 3.25 111.059 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.2 m -74.56 -25.72 19.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.684 -0.406 . . . . 1.12 110.728 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.05 -49.99 65.74 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.359 -0.382 . . . . 0.99 110.769 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 4.1 pt-20 -66.71 -35.94 81.31 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.328 -0.396 . . . . 1.4 110.258 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.561 ' SD ' ' HB3' ' A' ' 8' ' ' PHE . 16.3 ttm -65.18 -40.67 94.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.095 -0.502 . . . . 2.13 109.946 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 67.4 t90 -63.78 -48.03 78.53 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.793 -0.64 . . . . 0.47 109.645 178.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.8 ttpt -59.75 -46.89 87.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.785 -0.643 . . . . 1.71 110.396 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.549 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 0.8 OUTLIER -59.72 -47.14 86.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.989 -0.55 . . . . 1.96 110.526 179.798 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -61.37 -49.64 76.11 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.714 -0.675 . . . . 2.37 111.549 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 89.0 mmm -63.4 -28.38 69.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.376 -0.374 . . . . 1.15 111.937 -179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 73.6 mt -97.89 22.48 9.2 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 111.648 0.24 . . . . 1.39 111.648 -179.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.549 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 11.2 mtp180 -101.18 139.22 20.28 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.722 0.296 . . . . 3.14 110.689 179.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.26 -1.81 11.47 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 123.128 2.552 . . . . 1.07 112.789 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.15 17.34 21.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.998 -0.546 . . . . 1.64 110.751 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 24.2 t -123.32 114.8 43.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.082 -0.508 . . . . 1.17 111.15 -179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -67.23 159.65 28.66 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.93 -0.577 . . . . 2.2 110.02 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.35 -37.9 73.3 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.54 0.57 . . . . 1.52 112.54 -178.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -40.94 95.53 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.604 0.24 . . . . 4.09 110.613 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.1 mtm-85 -70.56 -36.46 73.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.407 -0.36 . . . . 3.61 110.465 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -65.37 -37.37 86.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.419 0.628 . . . . 1.15 109.369 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 19.2 tp -64.08 -36.81 85.23 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.585 -0.734 . . . . 1.87 109.595 178.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.3 mp -68.21 -39.37 82.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.41 -0.814 . . . . 2.11 109.819 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.29 -32.95 85.9 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 111.452 -0.659 . . . . 0.4 111.452 179.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.24 -40.19 86.29 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.431 -0.581 . . . . 1.88 109.431 178.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -60.35 -44.57 95.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.555 -0.748 . . . . 2.18 110.264 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 12.4 tp -63.25 -43.9 96.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.004 -0.544 . . . . 2.19 110.701 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.448 ' O ' HG23 ' A' ' 68' ' ' VAL . 12.7 tmm? -59.86 -49.62 76.98 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.006 -0.543 . . . . 1.17 110.392 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -59.25 -42.69 91.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.062 0.458 . . . . 2.22 110.325 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.403 ' CG ' ' HG ' ' A' ' 26' ' ' SER . 40.5 t-80 -61.99 -53.82 50.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.708 -0.678 . . . . 2.15 112.1 -179.295 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 35.8 m -62.05 -37.45 78.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 N-CA-C 112.89 0.7 . . . . 2.07 112.89 -177.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 64' ' ' MET . 33.0 m -79.06 -27.04 13.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 120.368 -0.533 . . . . 1.18 111.44 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -72.12 -49.06 39.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.995 0.426 . . . . 2.59 109.854 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -71.44 -20.21 62.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.805 -0.634 . . . . 2.55 110.614 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.1 -21.54 66.57 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.052 -0.522 . . . . 1.16 111.201 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.87 -31.47 69.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.775 0.322 . . . . 2.55 110.298 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -75.89 -40.78 29.8 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.632 -0.794 . . . . 0.66 111.232 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -79.52 -12.63 59.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.71 -0.245 . . . . 1.91 110.555 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 41.1 mttp 65.27 34.07 8.67 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 123.658 0.599 . . . . 3.18 110.93 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 27.0 mm -93.06 85.55 2.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.043 -0.526 . . . . 1.2 110.264 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 19.5 pt -69.95 -24.89 26.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.761 -0.654 . . . . 1.4 110.999 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.83 -35.47 74.81 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.104 -0.498 . . . . 2.37 110.713 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.407 ' CE2' ' HA ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -69.75 -49.13 56.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.249 -0.432 . . . . 2.23 110.333 179.633 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -63.31 -35.64 81.04 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.482 -0.781 . . . . 1.45 111.027 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.534 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 17.3 t70 -66.53 -51.11 60.19 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.081 0.467 . . . . 1.32 110.544 179.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.8 m -63.24 -42.28 99.2 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.447 -0.797 . . . . 1.18 111.84 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -77.87 -35.09 51.32 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.965 -0.294 . . . . 2.13 111.334 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.84 -40.89 98.87 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 121.393 -0.432 . . . . 0.34 113.845 -178.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.534 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 14.3 ptpt -65.98 -24.27 66.75 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 117.148 0.474 . . . . 1.9 112.234 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.2 m -105.1 -15.13 8.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 C-N-CA 120.914 -0.314 . . . . 1.04 111.022 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.73 -49.99 74.21 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.193 -0.458 . . . . 1.09 111.215 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.1 -41.61 75.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.496 . . . . 1.13 111.04 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.537 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 4.8 tp10 -62.62 -60.07 4.03 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.753 -0.658 . . . . 1.56 110.449 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.51 ' O ' HG12 ' A' ' 94' ' ' ILE . 72.6 t -56.45 -49.22 78.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.728 -0.669 . . . . 1.15 111.835 -178.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 54.4 mt -58.63 -38.32 77.82 Favored 'General case' 0 C--N 1.331 -0.22 0 O-C-N 123.146 0.279 . . . . 2.15 111.532 -179.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -70.6 -28.89 70.3 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.703 -0.761 . . . . 0.41 112.72 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.537 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 23.9 mmm-85 -83.44 -49.62 9.12 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 122.857 -0.202 . . . . 3.95 111.3 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.51 HG12 ' O ' ' A' ' 90' ' ' VAL . 20.8 pt -66.09 -20.37 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 N-CA-C 111.988 0.366 . . . . 1.22 111.988 -178.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.407 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 51.8 t30 -63.1 -28.16 69.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.333 0.587 . . . . 1.06 109.937 179.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -88.67 -13.21 40.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.724 -0.671 . . . . 1.57 110.738 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -97.1 -38.03 9.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.968 -0.56 . . . . 1.33 111.147 -179.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 14.0 m-30 -72.8 125.94 90.9 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 116.424 -0.353 . . . . 2.29 110.932 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.48 177.44 3.96 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.554 2.169 . . . . 1.47 112.029 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 13.8 ptt-85 -52.61 -36.05 55.57 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 112.862 0.69 . . . . 5.56 112.862 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.432 ' HA ' ' HE2' ' A' ' 104' ' ' LYS . 1.3 m-20 -76.66 -25.28 53.55 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.741 0.645 . . . . 2.58 112.741 -178.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 14.9 mt -93.37 -31.18 14.75 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.868 -0.333 . . . . 1.4 110.972 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . 0.449 ' HA ' HD22 ' A' ' 106' ' ' LEU . 32.0 pttt -63.14 -31.61 72.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.456 -0.338 . . . . 2.83 111.134 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.432 ' HE2' ' HA ' ' A' ' 101' ' ' ASP . 51.3 mtmt -64.43 -37.92 89.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.053 0.454 . . . . 2.98 110.302 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.6 mttm -70.46 -40.97 73.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.843 -0.617 . . . . 2.89 109.852 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.449 HD22 ' HA ' ' A' ' 103' ' ' LYS . 0.1 OUTLIER -65.31 -35.91 82.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.955 -0.566 . . . . 1.81 109.728 178.877 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 65.1 m -62.89 -37.18 85.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.185 -0.461 . . . . 1.53 110.362 178.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 39.1 mtt180 -65.05 -36.52 84.6 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 109.847 -0.427 . . . . 4.16 109.847 179.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 49.1 t -67.37 -49.76 68.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.991 -0.55 . . . . 1.81 110.013 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 71.0 t -59.16 -37.1 66.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.208 0.527 . . . . 1.68 110.043 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -60.12 -59.61 5.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.342 -0.844 . . . . 2.24 111.06 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.7 tt -61.41 -34.31 60.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 N-CA-C 111.847 0.314 . . . . 1.8 111.847 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 73.6 mt -63.09 -49.98 72.32 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.931 0.345 . . . . 1.98 111.931 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.6 ptpt -82.56 -29.1 30.54 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.07 0.396 . . . . 2.17 112.07 -178.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -67.18 -41.9 85.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.715 0.293 . . . . 2.2 110.908 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -90.8 3.69 53.72 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.529 -0.305 . . . . 3.8 110.523 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 51.27 59.28 4.71 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.618 -0.719 . . . . 2.23 111.059 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 46.6 mm -73.89 -38.75 50.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.677 -0.692 . . . . 1.26 109.888 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -107.15 169.52 8.51 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.691 -0.686 . . . . 2.11 109.569 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.52 157.67 19.83 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 123.27 0.356 . . . . 1.55 110.517 179.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.25 -35.39 69.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.506 -0.315 . . . . 3.34 111.429 -178.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -68.11 -37.01 80.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.826 0.346 . . . . 3.37 110.764 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 58.5 t -70.46 -47.11 67.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.326 -0.397 . . . . 1.92 110.88 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 27.5 m -66.21 -24.31 33.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.982 0.42 . . . . 1.92 110.43 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.27 -20.57 47.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.879 -0.601 . . . . 2.18 110.241 179.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.481 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 20.3 t0 -83.87 -39.57 19.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.421 0.629 . . . . 1.44 109.721 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 63.1 mt -61.93 -46.5 96.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.701 -0.681 . . . . 1.17 110.91 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -66.36 -37.85 86.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.431 -0.35 . . . . 2.05 111.764 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.481 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 30.5 ptt180 -68.93 -39.57 79.53 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.84 -0.344 . . . . 4.63 110.741 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 48.7 m -70.24 -35.37 73.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.948 0.404 . . . . 0.93 110.794 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.9 -45.6 81.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.181 -0.463 . . . . 2.04 110.266 179.269 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.83 -39.15 69.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.726 -0.67 . . . . 1.22 111.535 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.27 -31.68 72.3 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.82 0.343 . . . . 1.45 111.498 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.6 -19.56 65.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.098 -0.501 . . . . 1.28 111.589 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 95.3 mt 58.0 32.06 21.47 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.282 0.563 . . . . 4.46 111.095 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 95' ' ' ASN . 8.3 tp10 -99.29 1.21 44.4 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.954 -0.566 . . . . 6.64 110.75 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 . . . . . 0 C--O 1.244 0.771 0 CA-C-O 118.623 -0.704 . . . . 8.81 109.341 -179.986 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 206' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo . . . . . 0 N--CA 1.473 0.288 0 N-CA-C 111.657 -0.17 . . . . 7.93 111.657 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 50.1 m 70.0 74.58 0.22 Allowed 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 121.54 0.686 . . . . 6.33 112.575 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -65.37 133.06 50.56 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.861 -0.609 . . . . 4.66 110.507 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 209' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -52.25 -30.99 44.33 Favored 'Trans proline' 0 N--CA 1.476 0.443 0 C-N-CA 122.8 2.333 . . . . 4.88 113.432 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.56 8.82 23.36 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.918 0.389 . . . . 5.34 111.713 -179.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.52 74.24 47.22 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.643 -0.253 . . . . 3.29 110.349 179.318 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 213' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -64.37 -55.71 0.54 Allowed 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.47 2.113 . . . . 4.56 112.374 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.227 0 CA-C-O 118.254 -0.879 . . . . 6.05 109.359 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.942 0 CA-C-O 121.068 0.461 . . . . 5.77 110.657 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -123.7 124.7 43.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.379 -0.373 . . . . 6.18 110.393 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.2 m -105.16 124.58 49.77 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.712 -0.477 . . . . 3.04 109.712 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 m -84.89 -42.86 14.62 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.855 0.359 . . . . 3.56 111.403 -179.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -88.91 33.74 0.78 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.13 0.49 . . . . 2.9 111.301 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -65.25 -31.89 73.27 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.745 -0.661 . . . . 3.17 110.874 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -91.37 -38.05 12.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.961 -0.563 . . . . 1.44 110.634 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.84 -44.26 94.16 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.731 -0.668 . . . . 1.38 112.487 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 4.5 t -68.33 -26.85 65.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.645 0.259 . . . . 1.95 111.236 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.501 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 29.8 mmmt -68.8 -36.15 77.9 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 120.805 0.336 . . . . 1.78 110.146 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 42.9 mt -67.54 -34.84 77.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.913 -0.585 . . . . 2.19 110.669 179.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 -70.12 -31.28 68.74 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.75 -0.659 . . . . 1.96 111.621 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.5 t -104.09 16.52 26.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.751 0.31 . . . . 2.11 111.81 -179.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 8.1 mt -73.73 176.4 6.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.101 0.477 . . . . 1.63 111.342 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.467 ' HG2' ' H ' ' A' ' 17' ' ' ASP . 5.6 tt0 -146.25 168.8 20.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.715 -0.675 . . . . 2.16 109.552 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.467 ' H ' ' HG2' ' A' ' 16' ' ' GLU . 5.2 p-10 -84.16 10.26 10.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.193 0.521 . . . . 1.94 110.089 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.453 ' O ' HG12 ' A' ' 22' ' ' ILE . 1.4 t -77.16 129.04 35.45 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.509 -0.769 . . . . 1.89 110.53 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.571 ' OE1' ' HA ' ' B' ' 208' ' ' TYR . 3.2 mt-30 -65.34 -33.2 75.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.494 0.664 . . . . 3.13 109.841 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -66.93 -46.43 74.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.986 -1.006 . . . . 2.99 111.096 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.422 ' HG ' ' CB ' ' A' ' 18' ' ' SER . 42.6 p -69.14 -39.48 78.83 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 121.071 -0.252 . . . . 1.62 111.46 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 18' ' ' SER . 39.7 mm -59.25 -45.24 93.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 120.765 0.317 . . . . 1.52 110.383 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 t -63.97 -29.91 71.03 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.175 -0.466 . . . . 1.63 110.531 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.0 m -68.62 -31.12 70.06 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.134 -0.485 . . . . 1.4 110.399 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.15 -44.88 28.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.921 -0.582 . . . . 1.14 110.681 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.7 p -64.96 -33.18 75.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.313 -0.403 . . . . 1.62 110.673 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.436 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -63.1 -33.15 74.83 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.256 -0.429 . . . . 2.76 110.734 179.374 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 17.4 t90 -79.87 -34.51 39.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.05 0.452 . . . . 1.14 109.946 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.1 mp -63.78 -41.23 97.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.989 -0.55 . . . . 1.91 110.923 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.59 -21.08 66.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.459 -0.337 . . . . 1.71 111.803 -179.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 79.1 mt -76.24 -32.23 58.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.837 0.351 . . . . 2.2 110.634 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -105.19 59.8 0.68 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.671 0.748 . . . . 1.53 109.791 179.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 28.1 p90 -60.85 -21.34 63.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.137 -0.938 . . . . 2.35 111.831 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 66.7 mtt180 -77.86 -12.35 59.97 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.075 0.464 . . . . 4.54 110.506 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.34 7.09 44.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.044 -0.525 . . . . 1.7 110.492 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.464 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -51.31 -52.57 58.02 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-N 115.518 -0.765 . . . . 1.06 112.316 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.464 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 21.7 Cg_endo -61.76 -31.71 85.93 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 121.853 1.702 . . . . 0.62 112.227 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' A' ' 42' ' ' MET . 47.3 mtpt -73.17 -51.08 19.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.942 -0.572 . . . . 3.25 111.174 -179.205 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 28.0 m -67.96 -27.07 36.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 120.998 -0.281 . . . . 1.12 110.931 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.32 -51.44 60.61 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.934 0.397 . . . . 0.99 110.527 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -70.06 -34.94 73.84 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.382 -0.372 . . . . 1.4 110.12 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.418 ' HB2' ' O ' ' A' ' 38' ' ' LYS . 14.4 ttm -61.96 -42.22 98.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.972 -0.558 . . . . 2.13 109.655 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 53.4 t90 -63.35 -49.95 71.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.228 -0.896 . . . . 0.47 110.191 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.9 tmtt? -58.16 -46.51 85.58 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.764 -0.653 . . . . 1.71 110.949 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.503 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 64.7 mm-40 -61.54 -47.35 85.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.029 -0.532 . . . . 1.96 111.7 -179.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -65.39 -45.7 82.95 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.177 -0.465 . . . . 2.37 111.152 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 72.9 mmm -63.4 -28.39 69.95 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.196 0.443 . . . . 1.15 112.196 -178.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 15.4 mt -97.26 14.99 24.1 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 111.927 0.343 . . . . 1.39 111.927 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.503 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 79.5 mtt180 -89.29 139.76 28.56 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 110.301 -0.259 . . . . 3.14 110.301 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.08 -18.32 27.49 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.942 2.428 . . . . 1.07 112.685 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.23 -7.15 56.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.211 0.529 . . . . 1.64 111.252 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.2 t -97.81 125.27 51.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.034 -0.53 . . . . 1.17 110.853 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -74.49 152.71 39.36 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.695 -0.684 . . . . 2.2 110.015 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -34.64 64.07 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.12 0.415 . . . . 1.52 112.12 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.59 -34.47 78.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.845 0.355 . . . . 4.09 110.671 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.4 mmt-85 -74.4 -33.47 63.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.381 -0.372 . . . . 3.61 110.299 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 57.4 mttt -65.44 -32.28 73.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.08 -0.509 . . . . 1.15 109.956 179.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 75.3 mt -63.94 -43.13 96.8 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.397 -0.594 . . . . 1.87 109.397 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.5 mp -64.78 -41.53 95.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.395 -0.82 . . . . 2.11 110.068 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.31 -36.6 93.41 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.884 -0.674 . . . . 0.4 111.458 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 49.1 tp -69.79 -36.14 75.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.998 0.428 . . . . 1.88 110.065 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 9.8 m-30 -61.59 -40.11 93.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.706 -0.679 . . . . 2.18 110.648 179.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.75 -40.78 98.32 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.917 -0.583 . . . . 2.19 110.539 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.437 ' O ' HG21 ' A' ' 68' ' ' VAL . 13.4 tmm? -61.5 -51.39 68.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.357 -0.383 . . . . 1.17 110.441 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.433 ' O ' ' HB2' ' A' ' 69' ' ' GLN . 13.5 t30 -58.92 -35.91 73.85 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.968 0.413 . . . . 2.22 111.086 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.451 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 1.9 t-80 -74.84 -50.42 17.14 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.302 -0.408 . . . . 2.15 111.804 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 9.9 p -60.18 -39.28 80.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 112.092 0.404 . . . . 2.07 112.092 -178.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.437 HG21 ' O ' ' A' ' 64' ' ' MET . 33.6 m -75.01 -24.18 17.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 120.769 -0.372 . . . . 1.18 111.03 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 65' ' ' ASN . 3.0 tp-100 -67.91 -49.53 61.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.111 0.481 . . . . 2.59 110.151 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 9.2 pt20 -82.89 -14.95 53.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.793 -0.64 . . . . 2.55 111.202 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.64 -38.67 91.79 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 120.994 0.426 . . . . 1.16 110.191 179.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -68.76 -25.65 64.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.66 -0.7 . . . . 2.55 110.383 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.19 -31.06 79.44 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 111.067 -0.813 . . . . 0.66 111.067 178.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -99.02 -3.19 35.42 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.205 -0.665 . . . . 1.91 109.205 178.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.0 mttp 57.84 40.09 26.32 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 114.696 -1.138 . . . . 3.18 112.05 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 24.3 mm -90.99 90.8 3.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.585 -0.524 . . . . 1.2 109.585 179.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 18.5 pt -66.85 -14.19 17.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.863 -0.608 . . . . 1.4 111.689 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -58.48 -44.16 89.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.876 0.369 . . . . 2.37 110.254 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -70.96 -37.33 72.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.129 -0.487 . . . . 2.23 110.444 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -62.12 -37.42 85.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.911 -0.586 . . . . 1.45 110.851 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -80.26 -46.81 15.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.535 -0.302 . . . . 1.32 110.677 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.517 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 66.1 m -57.65 -52.1 66.82 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.057 -0.52 . . . . 1.18 111.786 -179.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -82.44 -21.01 35.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.547 -0.297 . . . . 2.13 111.485 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -64.4 -51.3 53.67 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.861 -0.685 . . . . 0.34 113.491 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.517 ' HE2' ' HA ' ' A' ' 82' ' ' SER . 25.9 pttt -68.15 -12.77 61.49 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.776 0.658 . . . . 1.9 112.776 -178.343 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 33.1 m -109.35 -16.03 9.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 120.719 -0.392 . . . . 1.04 111.417 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.14 87.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.358 -0.383 . . . . 1.09 111.1 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.86 -38.82 83.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.056 -0.52 . . . . 1.13 110.95 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -63.84 -52.91 57.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.745 -0.662 . . . . 1.56 110.614 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.52 ' O ' HG12 ' A' ' 94' ' ' ILE . 99.6 t -65.38 -45.2 93.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.822 -0.627 . . . . 1.15 111.265 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -58.49 -45.09 89.43 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.732 0.301 . . . . 2.15 111.268 -179.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -68.17 -26.06 74.27 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.729 -0.748 . . . . 0.41 112.505 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 4.8 mmm-85 -85.54 -46.97 10.33 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.862 0.319 . . . . 3.95 111.862 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.52 HG12 ' O ' ' A' ' 90' ' ' VAL . 43.1 pt -65.84 -26.86 39.67 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 C-N-CA 121.119 -0.232 . . . . 1.22 111.371 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 60.7 t30 -62.27 -26.74 68.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.062 0.458 . . . . 1.06 110.493 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -81.67 -35.59 29.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.065 -0.516 . . . . 1.57 110.422 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -81.34 -30.04 33.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.834 -0.621 . . . . 1.33 111.396 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -81.37 118.54 72.7 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 116.043 -0.526 . . . . 2.29 111.613 -179.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -64.35 -177.41 0.5 Allowed 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.91 2.406 . . . . 1.47 111.582 178.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 67.7 mtm-85 -51.08 -49.48 60.56 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.114 0.483 . . . . 5.56 111.422 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.51 -39.23 79.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.42 -0.809 . . . . 2.58 112.899 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 32.4 mt -86.91 -34.0 19.53 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.098 0.777 . . . . 1.4 113.098 -177.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . 0.546 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 0.4 OUTLIER -68.2 -20.97 64.88 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.681 -0.408 . . . . 2.83 111.115 -179.407 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -70.15 -21.69 63.05 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.064 0.459 . . . . 2.98 109.906 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 42.7 mttm -77.91 -45.94 22.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.659 -0.701 . . . . 2.89 110.653 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 103' ' ' LYS . 4.0 pp -65.11 -24.69 67.5 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 110.148 -0.316 . . . . 1.81 110.148 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 60.3 m -60.95 -37.75 83.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.111 0.481 . . . . 1.53 110.152 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 28.0 ttm180 -72.95 -37.29 67.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.88 -0.6 . . . . 4.16 109.724 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 60.3 t -62.85 -49.43 83.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.711 -0.677 . . . . 1.81 110.411 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 93.3 t -59.48 -36.61 65.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.746 -0.661 . . . . 1.68 110.595 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -59.91 -54.28 48.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.165 -0.471 . . . . 2.24 110.467 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 55.8 mt -62.09 -40.14 86.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.94 -0.573 . . . . 1.8 110.879 -179.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.456 ' HA ' ' CG1' ' A' ' 118' ' ' ILE . 5.6 mp -63.82 -34.71 78.52 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.885 -0.598 . . . . 1.98 112.323 -179.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.6 ptmm? -90.27 -37.94 13.75 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.417 0.525 . . . . 2.17 112.417 -178.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -72.94 -36.03 67.11 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.347 0.499 . . . . 2.2 112.347 -178.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -95.05 5.62 51.37 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.947 -0.301 . . . . 3.8 111.298 -178.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 51.51 71.23 0.46 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.445 0.64 . . . . 2.23 110.629 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.456 ' CG1' ' HA ' ' A' ' 113' ' ' LEU . 30.3 mm -83.94 -42.8 17.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.77 -0.65 . . . . 1.26 110.288 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -115.07 177.94 4.47 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.075 -0.511 . . . . 2.11 110.051 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.2 t -68.7 159.89 31.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.375 -0.375 . . . . 1.55 110.464 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 45.4 mtmt -56.46 -41.53 76.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.872 -0.604 . . . . 3.34 111.573 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -61.89 -37.61 85.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.012 -0.54 . . . . 3.37 110.497 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.458 ' O ' HG13 ' A' ' 127' ' ' ILE . 68.1 t -70.95 -46.15 69.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.961 -0.563 . . . . 1.92 110.462 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.414 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 88.0 t -56.35 -46.78 81.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.153 -0.476 . . . . 1.92 110.62 179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -63.03 -36.29 83.08 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.816 -0.629 . . . . 2.18 110.844 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -67.9 -40.06 83.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 1.44 110.305 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . 0.458 HG13 ' O ' ' A' ' 123' ' ' VAL . 85.3 mt -63.72 -47.08 92.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.187 -0.46 . . . . 1.17 110.272 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' A' ' 124' ' ' VAL . 43.8 mt-10 -58.23 -50.87 72.04 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.867 -0.606 . . . . 2.05 111.286 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 12.0 ptm180 -64.81 -26.03 68.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.432 -0.349 . . . . 4.63 111.599 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 74.0 m -68.47 -37.42 80.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.074 0.464 . . . . 0.93 110.343 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 29.5 mt -76.43 -41.87 46.07 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.856 -0.611 . . . . 2.04 110.595 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.03 99.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.853 -0.612 . . . . 1.22 111.8 -179.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.47 -30.44 71.56 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.256 -0.429 . . . . 1.45 111.427 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.34 -21.19 64.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 1.28 110.887 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 71.7 mt -99.28 3.13 46.07 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.074 -0.512 . . . . 4.46 110.403 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -99.36 29.03 4.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.898 -0.592 . . . . 6.64 110.474 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 9.1 t60 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.405 -0.807 . . . . 8.81 110.306 179.828 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 206' ' ' PRO . . . . . 0.432 ' HG2' ' HB2' ' A' ' 18' ' ' SER . 31.4 Cg_exo . . . . . 0 CA--C 1.532 0.391 0 N-CA-C 113.006 0.348 . . . . 7.93 113.006 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 17.5 m 63.35 93.68 0.05 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.441 0.638 . . . . 6.33 112.354 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . 0.571 ' HA ' ' OE1' ' A' ' 19' ' ' GLN . 34.7 t80 -75.93 131.15 39.45 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.981 -0.554 . . . . 4.66 111.235 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 209' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -58.95 -27.19 84.04 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.318 2.012 . . . . 4.88 112.102 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.63 7.15 47.24 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.801 -0.636 . . . . 5.34 110.825 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 54.4 m -136.92 87.69 19.06 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 3.29 110.586 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 213' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.74 -62.73 0.23 Allowed 'Trans proline' 0 CA--C 1.531 0.372 0 C-N-CA 123.26 2.64 . . . . 4.56 113.465 -179.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 67.0 m . . . . . 0 C--O 1.244 0.805 0 CA-C-O 118.54 -0.743 . . . . 6.05 110.064 -179.842 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.453 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 14.0 pt20 . . . . . 0 N--CA 1.462 0.159 0 N-CA-C 111.849 0.314 . . . . 2.75 111.849 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -82.87 -43.49 16.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.132 0.492 . . . . 0.91 110.083 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.77 -40.27 87.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.499 -0.773 . . . . 0.86 112.396 -179.244 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 19.4 m -65.13 -37.72 88.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.692 0.282 . . . . 1.42 111.632 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.506 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 16.8 mmmt -69.36 -33.88 73.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.698 -0.228 . . . . 1.3 111.124 -179.286 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.3 mt -66.58 -23.86 66.26 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.947 0.404 . . . . 1.57 111.277 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -98.05 2.98 49.34 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.235 -0.439 . . . . 1.59 111.841 -179.046 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.4 p -120.37 15.39 12.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.026 0.441 . . . . 1.63 111.059 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 69.7 mt -97.05 165.73 11.93 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.371 0.605 . . . . 1.1 111.674 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.447 ' HG2' ' N ' ' A' ' 17' ' ' ASP . 35.3 tt0 -134.09 166.94 21.57 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.198 -1.038 . . . . 2.16 108.198 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.447 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 6.0 p-10 -72.77 5.83 2.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.815 0.34 . . . . 1.94 111.293 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.9 t -84.26 139.67 32.18 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.474 -0.33 . . . . 1.61 110.422 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -62.0 -33.02 73.56 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.166 -0.47 . . . . 2.64 110.306 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.02 -28.45 69.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.791 -0.641 . . . . 2.99 110.165 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 t -81.26 -53.47 6.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.924 -0.58 . . . . 1.1 110.606 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.0 mm -56.66 -43.34 78.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.389 -0.368 . . . . 0.88 110.86 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.6 t -60.88 -35.19 75.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 1.18 111.113 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.6 m -64.05 -32.98 74.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.267 -0.424 . . . . 1.16 111.934 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.421 ' HB2' HD21 ' A' ' 15' ' ' LEU . . . -90.84 -35.73 14.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.87 0.367 . . . . 0.45 110.869 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 22.4 t -62.74 -49.34 75.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.114 -0.493 . . . . 1.32 110.664 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.41 -22.6 67.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 2.38 110.638 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.481 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 62.1 t90 -78.91 -32.36 45.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.924 -0.58 . . . . 0.98 109.865 179.113 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.692 HD11 HG11 ' A' ' 39' ' ' VAL . 11.5 tp -81.88 -36.83 27.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.917 -0.583 . . . . 1.3 110.883 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 79.2 mt -61.47 -22.55 65.17 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.609 0.596 . . . . 1.06 112.609 -179.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 4.3 pp -85.79 -9.37 57.17 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.646 -0.422 . . . . 1.71 111.187 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -123.21 56.45 1.18 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.605 0.717 . . . . 1.51 110.563 -179.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 27.0 p90 -64.01 -7.12 7.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.597 -0.729 . . . . 1.61 112.371 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -65.04 -34.26 78.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.027 0.441 . . . . 3.97 110.662 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -96.74 23.7 6.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.757 -0.656 . . . . 1.7 111.501 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -52.37 -54.51 41.21 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 112.601 0.593 . . . . 0.43 112.601 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.34 -29.11 46.4 Favored 'Trans proline' 0 C--N 1.355 0.89 0 C-N-CA 121.563 1.509 . . . . 0.5 112.34 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -72.71 -46.14 55.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.931 -0.577 . . . . 2.78 111.226 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.692 HG11 HD11 ' A' ' 29' ' ' LEU . 35.8 m -71.74 -26.19 25.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.781 -0.368 . . . . 0.39 110.6 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.94 -47.8 67.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.111 -0.495 . . . . 0.32 111.194 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -69.85 -36.23 75.37 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.825 -0.35 . . . . 1.4 110.448 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.2 mtm -63.89 -42.64 97.41 Favored 'General case' 0 CA--C 1.522 -0.129 0 N-CA-C 109.754 -0.462 . . . . 1.51 109.754 178.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 73.9 t90 -61.09 -47.09 87.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.575 -0.739 . . . . 0.41 109.463 178.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.464 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 37.3 ttpt -59.23 -51.46 69.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.362 -0.835 . . . . 1.11 110.606 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -58.78 -43.71 90.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.013 -0.539 . . . . 1.96 111.589 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -60.41 -47.32 86.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.313 -0.403 . . . . 1.58 111.37 -179.379 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 55.5 mtp -72.0 -11.76 60.92 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.77 0.285 . . . . 0.7 111.77 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 67.3 mt -95.17 -8.61 35.82 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.755 0.312 . . . . 0.88 110.65 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -79.89 130.02 68.5 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.331 -0.395 . . . . 2.69 110.472 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.15 -8.95 24.86 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.937 2.425 . . . . 0.94 112.436 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.43 -17.88 50.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.293 0.568 . . . . 1.33 110.133 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 76.9 t -89.3 111.06 22.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 CA-C-N 115.394 -0.821 . . . . 0.59 110.41 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -69.17 163.1 25.64 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.915 -0.584 . . . . 1.8 110.898 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.4 -34.98 59.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 0.81 111.878 -179.374 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 40.2 mmm-85 -58.45 -48.13 81.75 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.173 0.511 . . . . 3.58 110.49 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 36.7 mmt-85 -71.58 -35.73 70.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.789 -0.641 . . . . 3.05 110.761 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.3 mttt -61.72 -48.32 81.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.818 0.342 . . . . 0.59 110.372 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 24.2 tp -63.74 -37.03 85.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.149 -0.478 . . . . 1.26 110.409 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -64.44 -45.18 88.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.983 -0.553 . . . . 1.54 110.568 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.5 -31.01 77.48 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.912 -0.661 . . . . 0.37 112.015 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 43.4 tp -64.47 -36.95 85.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.959 0.409 . . . . 1.23 110.51 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -63.4 -40.17 96.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.016 -0.538 . . . . 1.38 110.85 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 27.0 tp -62.99 -36.51 83.79 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.182 -0.463 . . . . 1.45 111.029 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.448 ' O ' HG22 ' A' ' 68' ' ' VAL . 14.3 tmm? -65.84 -46.6 77.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.271 -0.422 . . . . 0.61 110.296 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -59.34 -39.1 82.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.075 -0.512 . . . . 1.69 110.772 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -63.44 -56.83 13.07 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.625 -0.716 . . . . 1.54 111.849 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 27.8 m -62.71 -38.98 83.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 113.28 0.844 . . . . 1.4 113.28 -177.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.448 HG22 ' O ' ' A' ' 64' ' ' MET . 32.6 m -73.91 -28.43 24.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 120.447 -0.501 . . . . 0.43 111.718 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -78.51 -45.56 21.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.776 0.322 . . . . 2.02 110.468 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -71.58 -17.94 62.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.311 -0.404 . . . . 2.1 110.875 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.49 -22.98 67.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.204 -0.453 . . . . 0.51 111.097 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.4 mmtt -63.19 -36.59 84.14 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.279 -0.418 . . . . 2.09 110.589 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -80.23 -28.81 47.74 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.741 -0.743 . . . . 0.66 111.886 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -80.1 -22.26 42.37 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.795 0.331 . . . . 1.62 110.279 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm 65.73 29.3 10.76 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.449 -0.796 . . . . 2.7 111.111 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 33.1 mm -104.15 92.87 2.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.514 -0.767 . . . . 0.63 109.508 179.273 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 17.3 pt -70.3 -14.57 18.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.935 -0.575 . . . . 0.86 111.304 -179.118 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 17.6 mp0 -55.69 -39.06 70.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.37 -0.377 . . . . 2.22 110.81 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -69.23 -50.68 45.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.117 -0.492 . . . . 1.34 110.766 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -63.89 -34.61 78.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.729 -0.669 . . . . 1.3 111.44 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.479 ' O ' ' HG2' ' A' ' 85' ' ' LYS . 6.7 t70 -67.54 -50.79 56.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.973 0.416 . . . . 1.32 110.456 179.292 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.7 m -66.05 -44.64 83.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.795 -0.639 . . . . 0.94 111.981 -179.097 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -75.49 -27.18 58.7 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 121.04 -0.264 . . . . 1.23 111.534 -179.319 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.71 -44.51 89.34 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.807 -0.711 . . . . 0.34 113.261 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' A' ' 81' ' ' ASP . 2.3 ptpp? -65.96 -27.4 68.12 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.05 0.389 . . . . 1.31 112.05 -179.061 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 35.3 m -93.8 -21.8 5.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 120.742 -0.383 . . . . 0.38 111.075 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' ' 91' ' ' LEU . . . -62.84 -43.07 99.77 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.275 -0.42 . . . . 0.38 110.98 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.58 -35.42 70.37 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.117 0.484 . . . . 0.45 110.998 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.648 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 6.1 tp10 -76.28 -56.29 4.78 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.97 -0.559 . . . . 1.56 110.279 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 70.5 t -56.91 -46.75 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.236 -0.438 . . . . 0.34 112.052 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.447 ' HB2' ' O ' ' A' ' 87' ' ' ALA . 2.4 mm? -60.23 -39.76 87.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.685 0.278 . . . . 1.45 110.587 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -67.93 -27.88 73.56 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.666 -0.778 . . . . 0.41 112.248 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.648 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 11.8 mmt85 -80.48 -50.9 9.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.666 0.27 . . . . 3.46 111.014 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.418 ' HA ' ' HG2' ' A' ' 97' ' ' GLU . 41.8 pt -64.56 -31.88 55.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 111.808 0.299 . . . . 0.5 111.808 -178.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -68.8 -17.37 64.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.701 0.286 . . . . 1.0 111.385 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 11.5 pt20 -106.93 8.12 30.37 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 122.014 -0.429 . . . . 1.14 111.776 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 6.2 pt-20 -129.79 -30.5 2.04 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.711 0.291 . . . . 1.33 111.096 178.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -71.47 139.52 84.08 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.382 -0.372 . . . . 1.39 111.055 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.456 ' HD2' HD12 ' A' ' 102' ' ' LEU . 37.0 Cg_endo -66.9 177.09 3.79 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.92 2.413 . . . . 1.47 112.337 178.745 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.522 ' O ' ' HG2' ' A' ' 103' ' ' LYS . 17.1 mmm-85 -57.33 -44.3 84.13 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.476 0.547 . . . . 4.87 112.476 -178.408 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.23 -32.62 74.15 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.673 0.249 . . . . 2.58 111.673 -178.755 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.456 HD12 ' HD2' ' A' ' 99' ' ' PRO . 15.6 mt -83.46 -35.54 24.87 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.823 -0.351 . . . . 0.85 111.497 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 100' ' ' ARG . 10.9 ptmm? -63.02 -33.17 74.86 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.915 0.388 . . . . 2.36 109.972 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 47.2 mttt -67.65 -39.6 84.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.058 -0.519 . . . . 2.57 110.645 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.499 ' O ' HG23 ' A' ' 109' ' ' VAL . 81.9 mttt -66.14 -42.77 88.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.786 -0.643 . . . . 2.44 110.679 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 103' ' ' LYS . 3.7 pp -72.51 -23.03 60.96 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.626 -0.429 . . . . 1.27 110.588 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 61.7 m -61.91 -45.08 95.26 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 116.53 -0.305 . . . . 1.15 110.537 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -73.52 -27.98 61.65 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.805 -0.358 . . . . 3.6 110.493 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.55 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 94.5 t -68.52 -47.22 78.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.335 -0.393 . . . . 1.25 110.209 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.422 ' HA ' HD12 ' A' ' 113' ' ' LEU . 9.3 p -75.69 -24.8 17.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 1.11 110.746 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -65.26 -48.4 73.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.283 -0.417 . . . . 1.74 110.479 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.444 HG22 ' O ' ' A' ' 109' ' ' VAL . 11.4 tt -63.61 -26.19 40.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.376 -0.375 . . . . 1.21 110.867 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 87.5 mt -67.59 -41.99 83.21 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.765 0.317 . . . . 1.33 111.003 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -84.49 -26.52 28.08 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.807 -0.357 . . . . 1.69 111.0 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -71.49 -35.36 70.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.833 0.349 . . . . 2.2 110.818 179.156 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 31.5 mmm180 -94.13 3.37 55.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.252 -0.431 . . . . 3.23 111.001 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 52.09 56.83 7.2 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.454 0.645 . . . . 2.0 110.433 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 44.5 mm -72.47 -46.45 55.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.457 -0.792 . . . . 0.61 111.116 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -105.55 170.46 7.88 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.265 -0.425 . . . . 1.26 110.994 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.16 147.09 53.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.958 -0.565 . . . . 1.3 110.302 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -57.24 -29.2 63.59 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.931 0.396 . . . . 2.85 111.343 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -59.56 -47.66 84.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.969 -0.559 . . . . 2.95 111.578 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.528 ' O ' HG13 ' A' ' 127' ' ' ILE . 10.8 p -84.86 -31.27 7.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.295 -0.411 . . . . 1.28 111.274 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 39.0 t -59.34 -43.1 89.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 120.913 0.387 . . . . 1.23 110.381 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -67.69 -20.25 65.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.804 -0.635 . . . . 1.74 111.045 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -83.35 -36.12 24.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.985 0.421 . . . . 1.44 110.266 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ILE . . . . . 0.528 HG13 ' O ' ' A' ' 123' ' ' VAL . 42.2 mt -68.04 -51.32 50.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.156 -0.474 . . . . 0.47 110.875 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.58 -38.41 84.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.37 -0.377 . . . . 2.05 111.84 -179.031 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 15.3 ptp180 -71.21 -33.85 70.3 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.738 -0.385 . . . . 3.98 110.65 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 67.8 m -65.16 -38.59 91.06 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.03 0.443 . . . . 0.7 110.225 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 127' ' ' ILE . 58.2 mt -65.74 -40.2 91.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.846 -0.616 . . . . 1.33 109.947 179.369 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.7 -33.85 66.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.784 -0.643 . . . . 0.69 111.103 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.47 -37.54 86.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.928 0.394 . . . . 0.84 111.126 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 116.05 -0.523 . . . . 1.12 110.888 180.0 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 . . . . . 0 CA--C 1.529 0.157 0 CA-C-O 121.036 0.446 . . . . 2.75 111.108 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -87.22 -40.36 14.62 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.102 -0.499 . . . . 0.91 110.059 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.39 -38.85 92.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.738 -0.665 . . . . 0.86 111.623 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.83 -29.78 69.79 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.327 -0.397 . . . . 1.42 110.83 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.485 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 62.4 mmtt -71.8 -42.91 66.5 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 120.973 0.416 . . . . 1.3 110.625 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.92 -23.53 67.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.832 -0.622 . . . . 1.57 111.395 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -95.21 5.04 52.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.163 -0.471 . . . . 1.59 112.028 -178.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 p -130.61 20.47 5.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 1.63 111.253 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 52.0 mt -102.87 133.17 48.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.865 0.364 . . . . 1.1 111.577 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -100.32 173.69 6.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.601 -0.727 . . . . 2.16 109.359 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -80.83 35.57 0.37 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.408 0.623 . . . . 1.94 110.896 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.483 ' HB3' ' OG ' ' A' ' 21' ' ' SER . 4.0 t -107.26 136.95 46.2 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.102 -0.499 . . . . 1.61 109.735 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.412 ' H ' ' HG2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -57.87 -44.0 86.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.935 -0.575 . . . . 2.64 111.289 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -62.97 -39.47 94.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.688 0.28 . . . . 2.99 111.432 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.483 ' OG ' ' HB3' ' A' ' 18' ' ' SER . 4.7 m -62.43 -50.56 71.01 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.356 -0.384 . . . . 1.1 110.387 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.9 mm -63.42 -38.43 82.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.261 -0.427 . . . . 0.88 109.983 179.511 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 47.0 t -60.31 -39.34 86.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.936 -0.574 . . . . 1.18 110.539 179.35 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.4 m -61.09 -45.42 94.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 1.16 110.752 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.12 -34.29 66.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.397 -0.365 . . . . 0.45 110.827 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 44.0 t -62.7 -50.75 69.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.972 -0.558 . . . . 1.32 110.373 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -59.12 -37.12 76.46 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.133 0.492 . . . . 2.38 110.495 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.453 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 9.3 t90 -66.39 -39.13 88.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.379 -0.828 . . . . 0.98 110.724 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.7 tp -76.05 -35.51 59.41 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.406 -0.361 . . . . 1.3 111.015 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 78.4 mt -60.18 -32.02 70.68 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.179 -0.464 . . . . 1.06 112.248 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 2.8 pp -78.62 -26.66 45.33 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.793 -0.363 . . . . 1.71 111.21 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -98.1 48.74 1.0 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.627 0.727 . . . . 1.51 110.669 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.6 p90 -70.9 -4.22 23.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.462 -0.79 . . . . 1.61 111.467 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -70.54 -30.09 66.73 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.168 -0.679 . . . . 3.97 109.168 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -107.94 31.87 5.18 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.202 -0.908 . . . . 1.7 110.091 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.456 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -51.57 -51.6 68.12 Favored Pre-proline 0 CA--C 1.537 0.452 0 CA-C-N 115.653 -0.703 . . . . 0.43 112.097 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 32.8 Cg_endo -64.42 -31.63 61.55 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 121.582 1.521 . . . . 0.5 111.822 179.212 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 42' ' ' MET . 0.6 OUTLIER -67.5 -47.74 69.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.866 -0.606 . . . . 2.78 111.247 -179.255 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.2 m -71.97 -27.51 27.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 C-N-CA 120.705 -0.398 . . . . 0.39 110.322 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.13 -47.27 62.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.166 -0.47 . . . . 0.32 110.426 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -68.66 -35.91 77.87 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.226 -0.443 . . . . 1.4 109.992 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.413 ' HB2' ' O ' ' A' ' 38' ' ' LYS . 14.7 ttm -64.26 -42.85 96.28 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.06 -0.518 . . . . 1.51 110.119 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 61.9 t90 -60.14 -52.08 66.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.446 -0.797 . . . . 0.41 110.674 179.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.0 ttpt -61.03 -50.22 74.23 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.633 -0.712 . . . . 1.11 111.629 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -61.46 -33.66 74.12 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.307 -0.406 . . . . 1.96 112.045 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -73.9 -44.51 55.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.628 0.251 . . . . 1.58 111.004 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 62.6 mtp -70.48 -13.46 62.13 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.002 0.371 . . . . 0.7 112.002 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 49.9 mt -92.93 2.15 56.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.943 0.401 . . . . 0.88 110.609 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 59.2 mtp180 -88.0 136.5 32.21 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.105 -0.498 . . . . 2.69 110.443 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -68.98 -12.61 34.78 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.793 2.328 . . . . 0.94 112.337 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.44 -6.35 56.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.791 -0.641 . . . . 1.33 111.191 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 42.3 t -100.38 118.53 47.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.94 0.4 . . . . 0.59 110.798 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -74.68 158.45 33.57 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.799 -0.637 . . . . 1.8 110.223 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -33.23 62.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.403 -0.362 . . . . 0.81 111.781 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.0 mmm-85 -59.48 -44.74 92.98 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.142 -0.481 . . . . 3.58 110.939 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.403 ' HD3' ' HA ' ' A' ' 56' ' ' ARG . 12.4 mmt180 -75.84 -30.35 58.92 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.436 -0.347 . . . . 3.05 110.88 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -64.16 -41.98 96.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.03 0.443 . . . . 0.59 109.888 179.029 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 25.6 tp -66.41 -40.57 89.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.832 -0.622 . . . . 1.26 110.216 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -64.53 -41.83 96.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.051 -0.522 . . . . 1.54 110.388 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.19 -36.68 93.17 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.791 -0.719 . . . . 0.37 111.619 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 30.6 tp -63.8 -35.9 82.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.937 0.399 . . . . 1.23 110.122 178.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -65.09 -41.21 95.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.862 -0.608 . . . . 1.38 110.773 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 23.9 tp -64.94 -42.47 94.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.262 -0.426 . . . . 1.45 110.495 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 14.1 tmm? -61.52 -45.64 93.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.033 -0.53 . . . . 0.61 110.154 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -61.36 -36.32 79.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.83 -0.623 . . . . 1.69 111.089 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.564 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 4.3 t-80 -67.05 -56.88 8.16 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.744 -0.662 . . . . 1.54 111.456 -179.442 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 35.0 m -59.74 -39.29 79.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.218 0.821 . . . . 1.4 113.218 -177.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 34.7 m -71.12 -27.31 29.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 120.466 -0.494 . . . . 0.43 112.049 -178.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 62.7 mt-30 -73.68 -46.44 46.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.942 0.401 . . . . 2.02 110.131 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.564 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 37.5 mm-40 -74.58 -21.33 59.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.863 -0.608 . . . . 2.1 110.934 -179.185 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.58 -35.01 71.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.304 -0.407 . . . . 0.51 111.1 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -74.68 -20.81 59.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.86 0.362 . . . . 2.09 110.634 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -73.77 -32.54 59.05 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.698 -0.763 . . . . 0.66 111.241 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -97.69 -0.76 44.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.186 0.517 . . . . 1.62 109.87 179.034 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.8 mmmm 63.19 40.68 8.63 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.12 -0.945 . . . . 2.7 111.252 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.3 mm -100.25 86.28 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.091 -0.504 . . . . 0.63 109.783 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 25.2 pt -68.78 -18.6 23.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.847 -0.615 . . . . 0.86 111.489 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -59.47 -41.49 89.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.09 -0.505 . . . . 2.22 110.834 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -66.68 -50.68 62.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.852 -0.613 . . . . 1.34 111.188 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -62.06 -34.47 76.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.674 -0.694 . . . . 1.3 111.885 -178.667 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.49 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 13.8 t70 -71.26 -53.68 13.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.706 0.288 . . . . 1.32 110.359 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.9 m -59.28 -44.09 92.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.882 -0.599 . . . . 0.94 112.04 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -77.29 -35.82 54.76 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.771 0.285 . . . . 1.23 111.771 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.85 -41.21 97.59 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 121.178 -0.534 . . . . 0.34 114.039 -178.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.49 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 12.7 ptpt -65.71 -31.12 71.94 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.324 0.49 . . . . 1.31 112.324 -178.61 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.3 m -95.83 -19.38 6.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.64 -0.424 . . . . 0.38 111.241 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.68 -42.14 99.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.394 -0.367 . . . . 0.38 111.242 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.29 -41.71 80.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.439 . . . . 0.45 110.985 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.622 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 6.3 tp10 -67.0 -54.04 25.57 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.902 -0.59 . . . . 1.56 110.493 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 96.0 t -59.3 -45.65 93.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 0.34 111.607 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -56.78 -44.16 81.58 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.538 -0.301 . . . . 1.45 111.293 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -66.97 -37.19 91.97 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.454 -0.879 . . . . 0.41 112.424 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.622 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 9.8 mmt180 -68.17 -48.4 65.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.696 0.284 . . . . 3.46 110.958 -179.652 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.493 ' HA ' ' HG2' ' A' ' 97' ' ' GLU . 45.2 pt -70.08 -23.88 25.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.079 0.466 . . . . 0.5 111.043 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASN . . . . . 0.486 ' ND2' ' HB3' ' A' ' 134' ' ' ALA . 7.1 t30 -65.79 -24.67 66.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.975 -0.557 . . . . 1.0 110.832 179.788 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.522 ' HB3' ' HB1' ' A' ' 134' ' ' ALA . 9.6 pt20 -110.63 1.25 17.9 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.55 0.574 . . . . 1.14 112.55 -178.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.493 ' HG2' ' HA ' ' A' ' 94' ' ' ILE . 1.5 pt-20 -117.69 -20.05 9.08 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.864 -0.334 . . . . 1.33 111.665 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -80.87 145.77 58.18 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 120.799 0.333 . . . . 1.39 111.279 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -66.26 171.78 9.83 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 123.046 2.498 . . . . 1.47 112.164 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -56.99 -42.66 80.65 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.565 0.58 . . . . 4.87 112.565 -178.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.21 -46.79 76.02 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 121.133 -0.227 . . . . 2.58 111.299 -178.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.487 HD23 ' HD2' ' A' ' 105' ' ' LYS . 36.7 mt -71.81 -29.69 64.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.827 0.346 . . . . 0.85 110.67 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' LYS . . . . . 0.428 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 0.0 OUTLIER -56.02 -50.89 69.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.773 -0.648 . . . . 2.36 110.574 179.53 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 57.1 tttt -66.04 -36.07 82.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.265 -0.425 . . . . 2.57 110.659 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.487 ' HD2' HD23 ' A' ' 102' ' ' LEU . 88.5 mttt -63.58 -44.06 95.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.148 -0.478 . . . . 2.44 110.913 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.473 ' O ' HG12 ' A' ' 109' ' ' VAL . 1.7 pp -74.54 -27.86 60.7 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.974 -0.291 . . . . 1.27 110.693 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 52.4 m -67.47 -41.05 85.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.515 -0.312 . . . . 1.15 111.242 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ARG . . . . . 0.462 ' O ' HG13 ' A' ' 112' ' ' ILE . 16.3 ptt180 -76.57 -31.75 57.74 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.848 -0.341 . . . . 3.6 110.708 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -69.02 -38.92 79.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-O 120.69 0.281 . . . . 1.25 110.637 -179.86 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 8.4 p -80.1 -21.13 11.83 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-O 121.257 0.551 . . . . 1.11 110.066 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -68.05 -41.6 81.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.743 -0.662 . . . . 1.74 109.625 179.397 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 108' ' ' ARG . 67.1 mt -62.64 -36.23 74.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.851 -0.613 . . . . 1.21 110.047 179.349 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 87.7 mt -61.84 -49.34 76.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 1.33 111.245 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -75.63 -28.04 58.65 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 121.008 -0.277 . . . . 1.69 111.59 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.448 ' HA ' ' OE1' ' A' ' 115' ' ' GLU . 2.6 mm-40 -73.71 -39.2 64.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.711 0.291 . . . . 2.2 111.064 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -83.79 -0.6 51.71 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.803 0.335 . . . . 3.23 110.367 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.89 48.42 8.92 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.435 -0.802 . . . . 2.0 110.808 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 42.9 mm -70.42 -46.14 72.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.75 -0.659 . . . . 0.61 109.979 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -101.84 164.71 11.58 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.811 -0.631 . . . . 1.26 110.19 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.6 t -68.77 145.82 53.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.211 -0.449 . . . . 1.3 110.162 179.275 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -59.03 -25.94 64.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.487 -0.324 . . . . 2.85 110.778 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -62.39 -38.56 90.08 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.074 -0.512 . . . . 2.95 111.09 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.473 ' O ' HG13 ' A' ' 127' ' ' ILE . 12.9 p -90.27 -31.48 5.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.841 -0.344 . . . . 1.28 110.504 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.405 ' O ' ' HG2' ' A' ' 128' ' ' GLU . 47.7 t -59.8 -38.33 75.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 120.984 0.421 . . . . 1.23 110.245 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -62.25 -26.53 68.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.809 -0.632 . . . . 1.74 110.77 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.528 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 38.7 t70 -87.28 -36.67 17.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.351 -0.386 . . . . 1.44 110.205 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ILE . . . . . 0.521 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 77.2 mt -60.89 -50.51 80.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.226 -0.443 . . . . 0.47 110.723 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 124' ' ' VAL . 4.6 pt-20 -63.73 -37.29 86.79 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.396 -0.365 . . . . 2.05 111.578 -179.515 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.528 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 6.5 ptp180 -70.34 -32.47 70.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.621 -0.263 . . . . 3.98 110.852 -179.203 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 49.0 m -65.89 -40.2 91.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.885 0.374 . . . . 0.7 110.394 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 127' ' ' ILE . 23.8 mt -66.26 -44.41 83.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.988 -0.551 . . . . 1.33 110.245 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.91 -36.63 78.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.886 -0.597 . . . . 0.69 111.715 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -59.25 -46.18 89.19 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.963 0.357 . . . . 0.84 111.963 -179.437 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ALA . . . . . 0.522 ' HB1' ' HB3' ' A' ' 96' ' ' GLN . . . . . . . . 0 C--N 1.324 -0.524 0 CA-C-O 120.855 0.359 . . . . 1.12 111.468 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 . . . . . 0 C--O 1.23 0.048 0 CA-C-O 120.834 0.349 . . . . 2.75 110.617 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -64.13 -47.38 80.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.945 -0.57 . . . . 0.91 110.285 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -39.14 93.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.06 -0.518 . . . . 0.86 110.881 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 12.2 m -63.36 -35.89 81.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.964 -0.562 . . . . 1.42 110.59 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.503 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 65.4 mmtt -65.04 -41.86 94.82 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.046 -0.524 . . . . 1.3 110.247 179.113 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -62.0 -34.49 76.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.853 -0.612 . . . . 1.57 111.235 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -77.98 -5.67 52.0 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.992 -0.549 . . . . 1.59 111.695 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 p -123.83 18.56 9.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.815 0.34 . . . . 1.63 111.604 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 17.0 mt -95.16 169.11 10.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.087 0.47 . . . . 1.1 111.39 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -139.79 -174.27 3.86 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.72 -0.673 . . . . 2.16 109.215 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -91.5 12.1 21.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.779 0.323 . . . . 1.94 111.424 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.478 ' O ' HG12 ' A' ' 22' ' ' ILE . 0.1 OUTLIER -85.41 132.25 34.25 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.867 -0.419 . . . . 1.61 109.867 179.093 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -29.37 70.29 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.69 0.281 . . . . 2.64 110.749 -179.455 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 -67.55 -44.09 79.1 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.811 -0.44 . . . . 2.99 109.811 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.1 m -64.63 -41.24 96.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.929 -0.578 . . . . 1.1 109.922 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 18' ' ' SER . 38.3 mm -63.41 -49.0 84.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 N-CA-C 109.257 -0.645 . . . . 0.88 109.257 178.633 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.8 m -57.28 -35.8 70.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.127 -0.488 . . . . 1.18 111.001 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.5 t -59.82 -40.07 87.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.456 . . . . 1.16 111.077 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.5 -43.65 13.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.319 -0.401 . . . . 0.45 111.206 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.405 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 37.9 m -59.36 -41.31 88.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.255 -0.43 . . . . 1.32 111.624 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.524 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 21.2 ttpt -61.95 -35.25 77.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.755 0.312 . . . . 2.38 110.194 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.526 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 25.0 t90 -72.81 -40.61 65.7 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.47 -0.567 . . . . 0.98 109.47 179.265 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -62.95 -38.46 91.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.831 -0.622 . . . . 1.3 110.756 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 26' ' ' SER . 86.4 mt -63.75 -28.26 69.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.985 0.421 . . . . 1.06 110.537 179.28 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 68.9 mt -76.09 -27.63 57.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.945 -0.571 . . . . 1.71 109.546 178.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' A' ' 28' ' ' TRP . 50.1 mm-40 -97.24 36.86 1.39 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.479 -0.782 . . . . 1.51 110.211 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.8 p90 -67.26 -1.58 4.74 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 121.057 0.456 . . . . 1.61 111.304 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -82.83 -8.8 59.55 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.02 -0.536 . . . . 3.97 109.86 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -131.39 37.75 3.67 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.687 -0.688 . . . . 1.7 110.343 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.439 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -57.36 -52.23 75.78 Favored Pre-proline 0 CA--C 1.537 0.481 0 CA-C-N 115.869 -0.605 . . . . 0.43 112.45 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.442 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 32.4 Cg_endo -64.74 -27.02 60.19 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 121.797 1.665 . . . . 0.5 112.362 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.6 -39.08 77.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.983 -0.553 . . . . 2.78 111.091 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 24.6 m -85.59 -22.58 7.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 120.61 -0.436 . . . . 0.39 110.669 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.36 -46.08 74.42 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.199 -0.455 . . . . 0.32 110.737 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 3.3 pt-20 -64.13 -40.75 96.84 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.257 -0.429 . . . . 1.4 110.052 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.422 ' N ' ' HG3' ' A' ' 41' ' ' GLU . 42.5 ttm -64.67 -41.07 96.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.596 -0.729 . . . . 1.51 110.521 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -62.18 -49.48 75.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.743 -0.662 . . . . 0.41 110.36 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.458 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 23.2 ttpp -57.82 -51.28 70.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.921 -0.581 . . . . 1.11 111.04 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.416 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 11.4 mm-40 -61.28 -38.65 87.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.144 -0.48 . . . . 1.96 111.168 -179.359 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.436 ' O ' HG21 ' A' ' 52' ' ' VAL . 79.1 t80 -62.03 -46.65 88.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.921 0.391 . . . . 1.58 110.67 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 76.9 mmm -67.05 -25.2 66.14 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.2 -0.454 . . . . 0.7 111.407 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 82.0 mt -93.94 12.7 25.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.396 -0.365 . . . . 0.88 111.299 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 11.9 mtp85 -96.66 133.56 24.39 Favored Pre-proline 0 C--N 1.327 -0.401 0 N-CA-C 110.333 -0.247 . . . . 2.69 110.333 179.349 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -70.28 -15.89 35.26 Favored 'Trans proline' 0 CA--C 1.53 0.284 0 C-N-CA 122.924 2.416 . . . . 0.94 113.307 -179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.69 10.47 7.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.032 0.444 . . . . 1.33 110.946 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.436 HG21 ' O ' ' A' ' 46' ' ' TYR . 41.2 t -110.39 122.0 64.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.949 -0.569 . . . . 0.59 110.514 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -69.01 156.45 38.6 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.96 -0.564 . . . . 1.8 110.93 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.12 -41.81 72.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.876 0.369 . . . . 0.81 111.73 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -68.89 -29.81 68.17 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.423 -0.353 . . . . 3.58 110.497 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.0 mmm-85 -70.96 -38.68 72.82 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.602 -0.518 . . . . 3.05 109.602 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -67.21 -34.82 78.3 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.377 -0.601 . . . . 0.59 109.377 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 20.1 tp -63.05 -37.97 89.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.581 -0.736 . . . . 1.26 109.927 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 mp -66.25 -40.59 90.3 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.688 -0.687 . . . . 1.54 110.007 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.66 -33.79 88.18 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.916 -0.659 . . . . 0.37 111.562 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.84 -44.13 86.41 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.391 -0.596 . . . . 1.23 109.391 178.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -61.78 -39.47 91.81 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.284 -0.871 . . . . 1.38 110.876 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 20.2 tp -63.6 -41.28 98.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.928 -0.578 . . . . 1.45 110.389 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.484 ' O ' HG22 ' A' ' 68' ' ' VAL . 16.9 tmm? -62.87 -51.57 66.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.886 -0.597 . . . . 0.61 110.699 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -56.11 -35.52 67.15 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.063 0.458 . . . . 1.69 110.923 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -68.67 -58.12 4.7 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.709 -0.678 . . . . 1.54 111.687 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 17.5 m -60.52 -39.86 82.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 113.052 0.76 . . . . 1.4 113.052 -177.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.484 HG22 ' O ' ' A' ' 64' ' ' MET . 30.7 m -72.96 -31.03 34.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 120.515 -0.474 . . . . 0.43 111.88 -178.916 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -77.7 -43.09 32.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.954 0.407 . . . . 2.02 110.473 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -71.52 -24.89 62.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.197 -0.456 . . . . 2.1 110.588 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.29 -18.72 65.52 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.297 -0.41 . . . . 0.51 110.566 179.123 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt -68.29 -29.21 67.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.27 -0.423 . . . . 2.09 109.879 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.2 -47.73 28.68 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.965 -0.636 . . . . 0.66 111.574 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -78.75 -7.68 58.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.919 0.39 . . . . 1.62 110.289 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.7 mttp 60.46 40.27 17.37 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.489 -0.778 . . . . 2.7 111.267 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 40.1 mm -93.25 94.79 4.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.766 -0.652 . . . . 0.63 109.813 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 10.9 pt -70.73 -22.47 23.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.083 -0.508 . . . . 0.86 111.224 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -56.23 -33.46 65.41 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.916 0.389 . . . . 2.22 110.702 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -71.51 -53.44 13.85 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.934 -0.576 . . . . 1.34 110.577 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -63.88 -31.54 72.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.82 -0.627 . . . . 1.3 111.799 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -71.23 -57.36 4.56 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.964 0.412 . . . . 1.32 111.426 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.9 m -65.36 -42.35 92.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.878 -0.601 . . . . 0.94 112.327 -178.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -78.32 -28.66 47.38 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.7 -0.4 . . . . 1.23 111.184 -179.422 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -68.23 -42.9 82.09 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.777 -0.725 . . . . 0.34 113.051 -179.39 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -65.3 -27.12 68.39 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.019 0.377 . . . . 1.31 112.019 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.6 m -97.26 -18.29 6.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-O 120.772 0.32 . . . . 0.38 111.316 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.23 -45.53 91.2 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.254 -0.43 . . . . 0.38 111.382 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -50.88 -46.69 60.56 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.386 0.429 . . . . 0.45 111.515 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.596 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 3.5 tp10 -62.43 -60.03 4.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.76 -0.654 . . . . 1.56 110.529 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.452 ' O ' HG12 ' A' ' 94' ' ' ILE . 80.0 t -54.97 -49.4 71.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.837 -0.619 . . . . 0.34 112.363 -178.615 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 82.0 mt -61.09 -38.0 84.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.611 0.243 . . . . 1.45 111.629 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -72.22 -31.06 64.2 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.544 -0.836 . . . . 0.41 112.0 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.596 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 47.8 mmm-85 -76.59 -50.35 14.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.514 0.197 . . . . 3.46 111.233 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.452 HG12 ' O ' ' A' ' 90' ' ' VAL . 22.2 pt -65.18 -20.82 28.24 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.282 0 CA-C-O 120.609 0.242 . . . . 0.5 111.167 -179.297 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -62.86 -26.8 68.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.687 0.755 . . . . 1.0 109.677 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -101.59 2.94 39.48 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.469 -0.787 . . . . 1.14 110.785 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -116.65 -15.87 10.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.134 -0.485 . . . . 1.33 111.281 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -95.1 125.63 49.77 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.22 -0.446 . . . . 1.39 111.193 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -61.79 174.5 2.28 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.719 2.279 . . . . 1.47 112.042 178.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.416 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 14.6 ptt-85 -49.95 -33.46 17.71 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.835 0.68 . . . . 4.87 112.835 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -75.07 -52.77 10.22 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.928 -0.309 . . . . 2.58 111.683 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 35.5 mt -66.75 -35.63 80.56 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.225 0.454 . . . . 0.85 112.225 -178.169 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -65.83 -30.18 70.76 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.857 -0.337 . . . . 2.36 110.821 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 100' ' ' ARG . 43.1 mtmt -68.63 -23.87 64.48 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.329 0.585 . . . . 2.57 109.748 178.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 52.9 mttp -84.14 -28.95 27.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.446 -0.797 . . . . 2.44 108.977 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 26.1 tp -64.51 -45.33 87.74 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.498 -0.774 . . . . 1.27 109.823 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 1.4 p -63.87 -25.87 68.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 1.15 110.674 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 39.3 mtt-85 -72.61 -24.35 61.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.949 -0.569 . . . . 3.6 110.982 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.5 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 49.0 t -91.48 -48.77 13.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 116.081 -0.509 . . . . 1.25 110.105 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 71.8 t -56.66 -44.36 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.67 -0.695 . . . . 1.11 112.187 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.93 -38.46 91.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.616 0.246 . . . . 1.74 111.256 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 57.9 mt -71.02 -40.05 75.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.801 0.334 . . . . 1.21 110.777 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 89.5 mt -58.72 -39.52 81.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 1.33 111.913 -179.237 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 11.7 ptpt -83.08 -40.86 19.3 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.976 -0.289 . . . . 1.69 111.759 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -66.71 -33.83 76.49 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.034 0.383 . . . . 2.2 112.034 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.7 mmm180 -85.73 0.04 53.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.751 -0.204 . . . . 3.23 110.993 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 56.14 52.03 10.95 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.33 0.586 . . . . 2.0 110.116 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 49.7 mm -77.35 -49.12 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.837 -0.62 . . . . 0.61 110.481 -179.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -102.25 171.98 7.16 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.087 -0.506 . . . . 1.26 110.327 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.22 158.83 35.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.998 -0.547 . . . . 1.3 110.341 179.374 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.417 ' O ' ' HB2' ' A' ' 125' ' ' ASN . 2.0 mmmt -57.41 -39.82 76.99 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.515 -0.311 . . . . 2.85 111.584 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -66.66 -27.77 67.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.749 0.309 . . . . 2.95 111.141 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 90.0 t -80.73 -51.22 16.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.47 -0.332 . . . . 1.28 111.243 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.516 ' O ' ' HG2' ' A' ' 128' ' ' GLU . 26.9 m -61.74 -30.2 47.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.772 0.32 . . . . 1.23 111.131 -179.451 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -72.29 -27.32 62.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.208 -0.451 . . . . 1.74 110.654 179.589 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -79.16 -36.27 40.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.187 -0.46 . . . . 1.44 110.023 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 81.3 mt -63.4 -54.61 30.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.873 -0.603 . . . . 0.47 111.049 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 124' ' ' VAL . 5.2 pt-20 -61.59 -38.68 88.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.351 -0.386 . . . . 2.05 111.794 -178.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -68.15 -29.25 68.1 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.751 -0.38 . . . . 3.98 110.724 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 65.0 m -72.17 -40.36 68.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.839 0.352 . . . . 0.7 110.161 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.1 mp -64.12 -39.42 93.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.191 0.519 . . . . 1.33 109.922 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.05 -42.28 63.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.502 -0.772 . . . . 0.69 111.213 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.44 -25.58 67.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.84 111.274 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.424 0 CA-C-N 116.096 -0.502 . . . . 1.12 110.75 179.406 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.481 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 18.5 mt-30 . . . . . 0 C--O 1.226 -0.152 0 N-CA-C 111.521 0.193 . . . . 2.75 111.521 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.618 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 82.4 t80 -77.12 -43.94 32.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.039 0.447 . . . . 0.91 110.785 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.0 -41.22 96.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.907 -0.588 . . . . 0.86 112.358 -179.276 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.9 t -69.39 -24.39 63.86 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.709 -0.223 . . . . 1.42 111.408 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 71.2 mmtt -68.11 -37.62 81.35 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.973 0.416 . . . . 1.3 110.052 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -62.22 -32.59 73.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.602 -0.726 . . . . 1.57 111.153 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 54.8 m-20 -77.57 -11.32 59.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.108 -0.496 . . . . 1.59 111.287 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.99 9.66 18.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.843 0.354 . . . . 1.63 111.465 -179.327 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 15' ' ' LEU . 17.9 mt -85.94 165.0 17.1 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.129 0.49 . . . . 1.1 111.372 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -144.18 169.58 17.61 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.581 -0.736 . . . . 2.16 109.458 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -84.38 41.9 0.86 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.425 0.631 . . . . 1.94 111.453 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -119.33 139.23 52.3 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.991 -0.55 . . . . 1.61 109.708 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.2 pm0 -61.39 -39.58 91.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.679 -0.237 . . . . 2.64 111.016 -179.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.77 -42.22 99.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.123 0.487 . . . . 2.99 110.258 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.8 m -65.28 -46.98 78.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.025 -0.534 . . . . 1.1 111.012 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 38.4 mm -65.39 -44.98 94.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 CA-C-N 116.354 -0.384 . . . . 0.88 110.235 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.9 t -56.18 -43.38 78.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.876 -0.602 . . . . 1.18 111.082 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.0 m -59.21 -36.85 76.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.247 -0.433 . . . . 1.16 111.868 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -83.01 -40.52 19.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.767 0.318 . . . . 0.45 111.111 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.6 m -62.29 -43.64 98.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.301 -0.409 . . . . 1.32 111.038 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.623 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 0.3 OUTLIER -64.06 -38.74 92.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.318 -0.401 . . . . 2.38 110.095 179.67 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 37.5 t90 -64.89 -38.57 91.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.025 -0.534 . . . . 0.98 110.287 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -67.09 -45.31 77.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.98 -0.555 . . . . 1.3 111.142 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 74.1 mt -64.26 -21.37 66.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.961 -0.563 . . . . 1.06 112.052 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 66.0 mt -70.64 -24.45 62.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.752 0.311 . . . . 1.71 110.991 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.15 72.08 1.45 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.087 0.47 . . . . 1.51 110.991 -179.573 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.5 p90 -75.17 9.18 2.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.94 -0.573 . . . . 1.61 110.729 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 33.1 mtp-105 -71.0 -25.1 62.54 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.782 -0.644 . . . . 3.97 110.499 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -117.13 33.3 5.69 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.128 -0.487 . . . . 1.7 110.645 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.428 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -54.62 -51.65 76.71 Favored Pre-proline 0 CA--C 1.538 0.485 0 CA-C-N 115.512 -0.767 . . . . 0.43 112.282 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.428 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 35.5 Cg_endo -66.03 -29.49 48.62 Favored 'Trans proline' 0 C--N 1.356 0.936 0 C-N-CA 121.602 1.535 . . . . 0.5 112.182 179.458 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.6 tptm -70.58 -45.96 64.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.46 -0.336 . . . . 2.78 110.867 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 35.5 m -72.64 -25.79 23.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 120.837 -0.345 . . . . 0.39 110.49 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.37 -50.12 49.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 0.32 110.655 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -66.67 -35.32 79.86 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 110.207 -0.294 . . . . 1.4 110.207 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.618 ' SD ' ' HB3' ' A' ' 8' ' ' PHE . 57.0 ttm -66.48 -40.82 89.52 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.02 0.438 . . . . 1.51 109.839 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -60.29 -49.13 78.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.508 -0.769 . . . . 0.41 109.503 178.461 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -57.39 -46.68 83.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.092 -0.958 . . . . 1.11 110.837 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -62.97 -43.89 97.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.801 -0.636 . . . . 1.96 111.413 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.43 ' O ' HG21 ' A' ' 52' ' ' VAL . 81.2 t80 -64.67 -45.14 87.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.884 0.373 . . . . 1.58 111.227 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 56.4 mmm -67.4 -22.53 65.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.138 -0.483 . . . . 0.7 112.051 -178.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.7 mt -103.72 32.35 3.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.917 0.389 . . . . 0.88 111.579 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 59.3 mtp180 -113.76 144.02 30.64 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 116.364 -0.38 . . . . 2.69 110.567 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.35 -16.31 31.18 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.833 2.355 . . . . 0.94 112.613 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.05 4.8 21.58 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.014 -0.539 . . . . 1.33 111.255 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.43 HG21 ' O ' ' A' ' 46' ' ' TYR . 41.3 t -115.33 120.9 66.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.299 -0.41 . . . . 0.59 110.789 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -74.41 155.16 38.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.842 -0.617 . . . . 1.8 110.614 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.65 -36.96 62.67 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 122.876 0.47 . . . . 0.81 112.214 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -35.02 78.84 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.961 0.41 . . . . 3.58 110.451 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.4 mmm-85 -73.9 -37.21 64.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.079 -0.51 . . . . 3.05 110.544 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 78.3 mttt -65.83 -32.25 73.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.049 -0.523 . . . . 0.59 109.755 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 32.0 tp -66.48 -40.64 89.41 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.072 -0.714 . . . . 1.26 109.072 178.202 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.6 mp -68.62 -39.81 80.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.503 -0.771 . . . . 1.54 110.187 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.34 -34.89 90.66 Favored Glycine 0 N--CA 1.452 -0.273 0 N-CA-C 111.58 -0.608 . . . . 0.37 111.58 179.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.2 tt -66.62 -39.97 88.58 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.335 -0.617 . . . . 1.23 109.335 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -61.32 -40.27 93.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.592 -0.731 . . . . 1.38 110.823 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.8 tp -62.16 -45.65 92.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.206 -0.452 . . . . 1.45 110.302 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.486 ' O ' HG22 ' A' ' 68' ' ' VAL . 16.0 tmm? -62.93 -47.17 84.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.854 -0.612 . . . . 0.61 109.838 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -56.45 -39.11 72.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.51 -0.768 . . . . 1.69 111.525 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -69.36 -53.0 21.72 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.004 -0.543 . . . . 1.54 111.447 -179.008 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 34.4 m -63.39 -32.6 57.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 112.731 0.641 . . . . 1.4 112.731 -178.28 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.486 HG22 ' O ' ' A' ' 64' ' ' MET . 34.5 m -80.07 -31.95 13.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.446 -0.502 . . . . 0.43 111.67 -179.542 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -75.48 -35.74 60.77 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.982 0.42 . . . . 2.02 110.594 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -84.09 -11.65 56.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.209 -0.45 . . . . 2.1 111.315 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.6 -23.46 66.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.445 -0.343 . . . . 0.51 111.087 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.4 ' HD3' HE22 ' A' ' 80' ' ' GLN . 3.4 mmmp? -66.77 -38.36 86.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.253 -0.431 . . . . 2.09 110.386 179.327 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -73.32 -30.52 62.5 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.923 -0.655 . . . . 0.66 111.658 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -81.13 -15.49 55.71 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.817 0.342 . . . . 1.62 110.329 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 62.9 mttp 65.1 26.67 12.51 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.446 -0.797 . . . . 2.7 110.679 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 36.7 mm -109.68 86.37 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.638 -0.71 . . . . 0.63 109.423 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.409 HG13 ' OE1' ' A' ' 78' ' ' GLN . 2.0 pp -73.11 -12.05 15.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.123 -0.489 . . . . 0.86 110.753 -179.35 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.409 ' OE1' HG13 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -59.74 -35.57 74.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.962 -0.563 . . . . 2.22 110.165 179.321 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.51 -43.7 89.25 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.299 0.571 . . . . 1.34 109.5 178.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.4 HE22 ' HD3' ' A' ' 72' ' ' LYS . 75.2 mt-30 -68.92 -36.97 78.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.194 -0.912 . . . . 1.3 111.191 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.406 ' O ' ' HG2' ' A' ' 85' ' ' LYS . 30.2 t70 -69.96 -43.95 70.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.901 0.382 . . . . 1.32 110.931 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' SER . . . . . 0.43 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 39.8 m -62.87 -44.44 96.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.052 -0.522 . . . . 0.94 111.193 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -79.22 -33.39 43.76 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-N 116.318 -0.401 . . . . 1.23 111.297 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.15 -44.27 94.9 Favored Glycine 0 N--CA 1.453 -0.226 0 N-CA-C 114.211 0.445 . . . . 0.34 114.211 -178.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.43 ' HE2' ' HA ' ' A' ' 82' ' ' SER . 0.0 OUTLIER -66.18 -20.88 66.27 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.204 0.446 . . . . 1.31 112.204 -178.772 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 20.4 m -106.41 -17.2 7.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.898 0.38 . . . . 0.38 110.902 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.76 -46.98 85.52 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.131 -0.486 . . . . 0.38 111.011 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.49 -40.43 71.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.254 -0.43 . . . . 0.45 110.735 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -66.27 -58.61 4.98 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.805 -0.634 . . . . 1.56 110.169 179.426 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.514 ' O ' HG12 ' A' ' 94' ' ' ILE . 81.7 t -56.02 -49.72 73.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.945 -0.571 . . . . 0.34 111.905 -178.837 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 94.8 mt -59.03 -43.45 91.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.817 -0.174 . . . . 1.45 111.424 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -65.82 -32.29 82.39 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.757 -0.735 . . . . 0.41 112.401 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 34.7 mmm-85 -77.55 -52.93 8.24 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.528 0.204 . . . . 3.46 111.245 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.514 HG12 ' O ' ' A' ' 90' ' ' VAL . 37.9 pt -66.97 -18.8 24.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.452 -0.34 . . . . 0.5 111.361 -179.048 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -61.64 -30.93 71.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.394 0.616 . . . . 1.0 109.812 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -85.74 -14.98 43.62 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.576 -0.738 . . . . 1.14 110.375 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -92.11 -38.12 12.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.907 -0.588 . . . . 1.33 110.773 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 -67.28 122.03 81.16 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.566 -0.743 . . . . 1.39 111.383 -179.071 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -71.85 -175.88 1.84 Allowed 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.476 2.117 . . . . 1.47 112.337 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 15.9 ptt-85 -55.56 -27.37 48.76 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 113.119 0.785 . . . . 4.87 113.119 -178.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ASP . . . . . 0.44 ' HA ' ' CE ' ' A' ' 104' ' ' LYS . 33.4 t70 -81.15 -46.09 15.42 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.654 -0.418 . . . . 2.58 111.845 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 22.5 mt -73.86 -29.2 61.97 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.363 0.505 . . . . 0.85 112.363 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 57.1 pttt -58.85 -28.42 66.06 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.792 0.329 . . . . 2.36 111.149 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.44 ' CE ' ' HA ' ' A' ' 101' ' ' ASP . 41.0 mtmt -64.42 -50.91 65.72 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.04 0.448 . . . . 2.57 110.599 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 40.9 mttp -68.47 -33.55 74.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.854 -0.612 . . . . 2.44 110.093 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 16.6 tp -63.39 -48.26 78.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.717 -0.674 . . . . 1.27 110.641 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.8 p -66.57 -33.57 75.96 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.941 -0.304 . . . . 1.15 110.796 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 39.0 mtt180 -64.08 -52.43 59.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.157 -0.474 . . . . 3.6 111.472 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.482 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 6.2 p -61.48 -42.17 92.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 121.085 -0.246 . . . . 1.25 110.961 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 50.5 t -60.4 -43.89 94.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 121.017 0.437 . . . . 1.11 110.175 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.424 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 2.7 t-20 -60.11 -47.34 86.29 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.589 -0.732 . . . . 1.74 110.693 179.683 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 78.8 mt -63.59 -44.35 98.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.305 -0.407 . . . . 1.21 111.139 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 87.1 mt -60.28 -44.01 95.73 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.973 0.36 . . . . 1.33 111.973 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.424 ' HG3' ' O ' ' A' ' 111' ' ' ASN . 2.0 ptpt -75.1 -35.4 61.76 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.91 -0.316 . . . . 1.69 111.506 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -71.07 -27.07 63.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.634 0.255 . . . . 2.2 111.282 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 6.4 mtt-85 -90.76 -4.0 57.0 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.67 -0.493 . . . . 3.23 109.67 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 56.09 54.89 7.37 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.089 -0.959 . . . . 2.0 110.16 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 37.8 mm -73.86 -45.83 48.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.344 -0.844 . . . . 0.61 110.602 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -100.31 171.53 7.72 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.966 -0.561 . . . . 1.26 110.736 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.8 163.08 20.09 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.931 -0.577 . . . . 1.3 111.224 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.3 mmmp? -55.4 -43.38 75.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 2.85 111.683 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.92 -23.05 64.12 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.016 -0.538 . . . . 2.95 111.659 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 61.4 t -85.19 -49.18 15.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 121.144 -0.223 . . . . 1.28 111.26 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 27.8 m -61.17 -30.54 48.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.883 0.373 . . . . 1.23 111.181 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -80.84 -28.46 36.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 1.74 110.86 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.45 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 10.9 t70 -73.41 -40.55 64.18 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.017 0.437 . . . . 1.44 110.179 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 91.0 mt -60.62 -52.51 60.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.98 -0.555 . . . . 0.47 111.526 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -63.11 -33.98 76.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.227 0.454 . . . . 2.05 112.227 -178.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 13.1 ptt180 -74.81 -33.81 62.26 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.426 -0.51 . . . . 3.98 110.943 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 39.3 m -66.04 -44.62 84.1 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.983 0.42 . . . . 0.7 110.734 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.5 mp -62.04 -36.83 82.77 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.119 -0.491 . . . . 1.33 110.447 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.36 -41.15 66.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.785 -0.643 . . . . 0.69 110.851 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.05 -34.11 74.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.366 -0.379 . . . . 0.84 111.432 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.447 . . . . 1.12 111.177 179.803 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.429 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 97.0 mt-30 . . . . . 0 C--O 1.228 -0.05 0 CA-C-O 121.091 0.472 . . . . 2.75 109.737 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -72.6 -49.57 31.24 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.86 -0.609 . . . . 0.91 110.11 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -36.67 80.21 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.784 -0.644 . . . . 0.86 112.015 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.1 t -72.66 -26.95 61.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.455 -0.339 . . . . 1.42 110.674 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.429 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 22.6 mmmt -69.37 -27.78 65.62 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-O 120.701 0.286 . . . . 1.3 110.589 179.542 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.86 -29.87 71.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.956 -0.566 . . . . 1.57 110.577 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -81.48 -20.8 39.44 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.054 -0.521 . . . . 1.59 110.496 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.2 p -101.16 24.69 9.09 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.066 -0.515 . . . . 1.63 111.554 -179.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 15' ' ' LEU . 15.8 mt -77.36 165.44 24.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.037 0.446 . . . . 1.1 111.373 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -144.88 168.25 20.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.82 -0.627 . . . . 2.16 109.377 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -82.62 -20.85 35.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.663 0.268 . . . . 1.94 111.316 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.455 ' HB2' ' OG ' ' A' ' 21' ' ' SER . 3.5 m -61.61 133.87 56.15 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 1.61 111.082 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.02 -34.89 79.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.85 -0.614 . . . . 2.64 110.554 -178.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -66.15 -38.66 88.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.821 -0.627 . . . . 2.99 110.745 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.455 ' OG ' ' HB2' ' A' ' 18' ' ' SER . 4.3 m -68.16 -38.9 82.61 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.147 -0.479 . . . . 1.1 110.163 179.699 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.9 mm -67.32 -34.97 72.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 N-CA-C 109.047 -0.723 . . . . 0.88 109.047 178.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.0 m -63.26 -33.78 76.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.185 -0.916 . . . . 1.18 111.179 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.1 m -62.43 -47.58 83.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 1.16 110.722 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.35 -40.66 81.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.101 -0.5 . . . . 0.45 110.632 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 29.1 t -61.32 -48.89 79.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.025 -0.534 . . . . 1.32 110.771 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -26.8 68.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 2.38 111.1 -179.583 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 13.9 t90 -78.15 -37.83 45.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.153 -0.476 . . . . 0.98 110.169 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -67.52 -35.4 79.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.669 -0.696 . . . . 1.3 110.911 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.7 -23.9 67.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.408 -0.36 . . . . 1.06 111.774 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 68.4 mt -81.09 -20.75 40.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.074 0.464 . . . . 1.71 111.065 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -110.27 41.45 1.74 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.11 0.481 . . . . 1.51 110.443 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 54.6 p90 -59.11 -20.6 54.95 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.802 -0.635 . . . . 1.61 112.098 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.3 ttp180 -71.47 -25.49 62.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.034 0.445 . . . . 3.97 110.711 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.33 16.97 25.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.897 -0.592 . . . . 1.7 110.739 -179.464 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.503 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.38 -50.88 77.27 Favored Pre-proline 0 CA--C 1.536 0.404 0 CA-C-N 115.735 -0.666 . . . . 0.43 112.51 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 18.1 Cg_endo -59.81 -31.69 94.32 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 121.83 1.687 . . . . 0.5 112.708 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.3 tptt -76.57 -41.22 47.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.318 -0.401 . . . . 2.78 111.345 -178.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.1 m -73.17 -29.77 29.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 C-N-CA 120.396 -0.522 . . . . 0.39 110.546 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.83 -46.41 71.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.185 -0.461 . . . . 0.32 111.34 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 7.4 pt-20 -64.84 -40.78 95.72 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 110.049 -0.352 . . . . 1.4 110.049 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 65.7 mtm -65.47 -37.31 86.47 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.961 0.41 . . . . 1.51 109.945 179.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 63.5 t90 -59.55 -48.27 82.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.493 -0.776 . . . . 0.41 109.742 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.405 ' HE3' HD12 ' A' ' 48' ' ' LEU . 8.9 ttpt -60.83 -45.07 95.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.209 -0.451 . . . . 1.11 110.676 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.536 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 10.0 mm-40 -60.53 -47.09 87.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.963 -0.562 . . . . 1.96 110.851 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -65.43 -44.18 88.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 1.58 111.115 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 70.3 mmm -66.16 -22.98 66.39 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.104 0.409 . . . . 0.7 112.104 -179.086 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.405 HD12 ' HE3' ' A' ' 44' ' ' LYS . 51.3 mt -99.68 7.47 45.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.602 0.239 . . . . 0.88 111.487 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.536 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 41.9 mtp180 -84.92 132.57 45.49 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.954 -0.387 . . . . 2.69 109.954 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -67.07 -11.69 33.23 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.754 2.303 . . . . 0.94 112.59 -179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -16.43 59.24 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.171 0.51 . . . . 1.33 110.6 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.2 t -92.18 123.87 44.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.799 -0.637 . . . . 0.59 110.769 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -69.61 153.31 43.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.795 -0.639 . . . . 1.8 110.601 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.35 -39.69 64.35 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.017 -0.538 . . . . 0.81 112.354 -179.477 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -68.82 -32.6 72.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.845 0.355 . . . . 3.58 110.954 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.7 mmt85 -71.45 -32.65 68.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.314 -0.403 . . . . 3.05 110.016 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.1 mttt -67.65 -34.29 76.66 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.452 -0.573 . . . . 0.59 109.452 178.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 40.8 tp -63.3 -43.64 97.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.773 -0.648 . . . . 1.26 109.797 178.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 94.1 mt -65.47 -40.76 93.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.812 -0.631 . . . . 1.54 110.034 179.01 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.9 -30.69 78.46 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.983 -0.627 . . . . 0.37 111.743 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 25.8 tp -71.78 -38.82 70.25 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.918 0.389 . . . . 1.23 110.138 178.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -65.96 -31.37 72.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.961 -0.563 . . . . 1.38 110.568 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 56.7 tp -65.73 -44.5 85.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.956 -0.565 . . . . 1.45 110.627 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.474 ' HG3' ' N ' ' A' ' 65' ' ' ASN . 0.0 OUTLIER -67.13 -34.61 77.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.61 110.841 -179.61 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.474 ' N ' ' HG3' ' A' ' 64' ' ' MET . 11.2 t30 -63.44 -37.29 86.73 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.343 0.592 . . . . 1.69 110.528 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -68.22 -52.87 29.3 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.382 -0.826 . . . . 1.54 111.295 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.417 HG12 ' HA ' ' A' ' 64' ' ' MET . 7.1 p -63.43 -39.42 85.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 112.9 0.704 . . . . 1.4 112.9 -177.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.465 HG22 ' O ' ' A' ' 64' ' ' MET . 33.5 m -73.57 -24.58 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 C-N-CA 120.416 -0.514 . . . . 0.43 111.517 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -75.18 -47.66 27.3 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.111 -0.329 . . . . 2.02 110.111 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -72.08 -23.16 61.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.186 -0.461 . . . . 2.1 110.732 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.09 -29.09 70.07 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-N 116.392 -0.367 . . . . 0.51 111.125 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.479 ' HD2' ' HA ' ' A' ' 118' ' ' ILE . 42.8 mtpt -68.01 -34.88 77.34 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.441 -0.345 . . . . 2.09 110.371 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.46 -30.4 75.08 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.924 -0.655 . . . . 0.66 111.753 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -95.62 -2.09 48.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.731 0.3 . . . . 1.62 110.447 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm 62.01 23.75 14.04 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.686 -0.688 . . . . 2.7 112.121 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 23.3 mm -86.36 78.91 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.861 -0.422 . . . . 0.63 109.861 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 10.3 pt -64.42 -11.71 10.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.861 -0.609 . . . . 0.86 111.71 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.96 -26.75 68.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.095 -0.502 . . . . 2.22 110.492 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -73.5 -51.23 17.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 1.34 110.865 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -63.96 -28.65 69.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 1.3 111.311 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -73.24 -50.28 23.22 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.208 0.527 . . . . 1.32 109.968 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' SER . . . . . 0.436 ' HA ' ' HE3' ' A' ' 85' ' ' LYS . 23.4 m -64.4 -47.1 80.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.455 -0.793 . . . . 0.94 111.65 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -76.77 -30.22 56.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.605 0.24 . . . . 1.23 111.308 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.7 -42.21 93.38 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.078 -0.582 . . . . 0.34 113.479 -179.158 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.436 ' HE3' ' HA ' ' A' ' 82' ' ' SER . 9.7 ptpt -60.55 -27.06 67.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.752 0.276 . . . . 1.31 111.539 -179.152 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.416 HG13 ' HG3' ' A' ' 85' ' ' LYS . 17.1 m -103.29 -14.64 8.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.707 0.289 . . . . 0.38 111.564 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.74 -44.61 93.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.427 -0.351 . . . . 0.38 111.323 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.27 -36.81 69.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.098 0.475 . . . . 0.45 111.016 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 5.8 tp10 -72.69 -58.61 3.22 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.598 -0.728 . . . . 1.56 110.62 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 96.2 t -54.91 -50.34 62.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.85 -0.614 . . . . 0.34 112.107 -178.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.534 HD13 HD11 ' A' ' 94' ' ' ILE . 3.3 mm? -58.24 -42.22 85.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.531 0.205 . . . . 1.45 111.355 -179.119 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -67.66 -35.06 85.24 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.573 -0.823 . . . . 0.41 112.426 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 15.8 mmp_? -75.68 -48.76 20.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.548 0.213 . . . . 3.46 111.566 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.534 HD11 HD13 ' A' ' 91' ' ' LEU . 43.5 pt -65.97 -25.46 36.09 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 C-N-CA 121.062 -0.255 . . . . 0.5 111.589 -178.535 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -63.15 -21.79 66.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.432 0.634 . . . . 1.0 110.189 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -97.27 -33.73 11.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.722 -0.672 . . . . 1.14 110.804 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -76.3 -32.83 58.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 1.33 111.055 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -80.82 132.83 56.4 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.12 -0.491 . . . . 1.39 110.226 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.408 ' HD2' HD12 ' A' ' 102' ' ' LEU . 28.7 Cg_endo -63.42 166.35 15.41 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.352 2.035 . . . . 1.47 110.835 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.483 ' HA ' ' HG2' ' A' ' 103' ' ' LYS . 0.0 OUTLIER -59.44 -21.61 60.28 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.945 0.35 . . . . 4.87 111.945 -178.758 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.27 -25.79 51.8 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.831 0.348 . . . . 2.58 110.969 179.704 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.408 HD12 ' HD2' ' A' ' 99' ' ' PRO . 26.4 mt -98.66 -26.81 14.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.575 -0.284 . . . . 0.85 111.736 -178.699 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' LYS . . . . . 0.483 ' HG2' ' HA ' ' A' ' 100' ' ' ARG . 0.0 OUTLIER -61.13 -25.19 66.82 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.002 0.429 . . . . 2.36 110.541 -179.87 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.548 ' O ' ' HG3' ' A' ' 108' ' ' ARG . 53.2 mttm -65.48 -35.39 80.77 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.028 -0.533 . . . . 2.57 110.216 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 18.5 mtpp -69.94 -49.89 47.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.945 -0.57 . . . . 2.44 110.925 -179.23 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.478 ' CD2' ' HA ' ' A' ' 103' ' ' LYS . 3.2 pp -65.78 -27.92 68.63 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.684 0.278 . . . . 1.27 110.657 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.1 t -63.78 -37.64 88.13 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.265 -0.425 . . . . 1.15 110.03 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 104' ' ' LYS . 8.3 mtp85 -66.42 -40.66 89.69 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.423 -0.584 . . . . 3.6 109.423 179.18 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.583 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 47.3 t -59.56 -56.95 13.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.159 -0.928 . . . . 1.25 110.732 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 44.7 t -57.85 -41.19 79.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.078 -0.51 . . . . 1.11 111.13 -179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -58.92 -49.08 79.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.301 -0.409 . . . . 1.74 110.524 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 96.9 mt -65.18 -38.3 82.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.712 0.291 . . . . 1.21 110.685 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 96.0 mt -59.67 -43.21 94.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.312 -0.404 . . . . 1.33 111.231 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -79.94 -33.25 39.81 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.899 -0.321 . . . . 1.69 111.07 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -66.0 -44.7 84.01 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.717 0.294 . . . . 2.2 111.022 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 85.8 mtt180 -87.03 7.27 28.44 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.548 -0.296 . . . . 3.23 111.103 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 47.84 58.89 4.59 Favored 'General case' 0 C--O 1.235 0.315 0 O-C-N 123.77 0.669 . . . . 2.0 110.84 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.479 ' HA ' ' HD2' ' A' ' 72' ' ' LYS . 40.4 mm -73.65 -48.02 42.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.855 -0.612 . . . . 0.61 110.939 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -101.93 174.76 5.8 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.024 -0.535 . . . . 1.26 110.838 -179.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' SER . . . . . 0.42 ' O ' HG23 ' A' ' 124' ' ' VAL . 26.7 t -71.18 139.6 50.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.058 -0.519 . . . . 1.3 109.761 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -53.23 -30.35 37.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.417 -0.356 . . . . 2.85 111.712 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -61.92 -49.48 76.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.93 0.395 . . . . 2.95 111.132 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.533 ' O ' HG13 ' A' ' 127' ' ' ILE . 3.9 p -79.22 -27.89 13.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.301 -0.409 . . . . 1.28 111.032 -179.335 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 120' ' ' SER . 43.3 t -60.98 -42.21 92.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.206 0.527 . . . . 1.23 109.81 179.164 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -61.88 -37.89 86.27 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.442 -0.799 . . . . 1.74 110.391 179.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -67.35 -36.48 81.5 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.142 -0.481 . . . . 1.44 110.452 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 123' ' ' VAL . 70.1 mt -63.58 -49.33 82.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.084 0.469 . . . . 0.47 109.832 178.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -62.06 -40.1 94.64 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.743 -0.662 . . . . 2.05 110.544 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 41.7 mmt-85 -62.1 -43.47 98.77 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.255 -0.43 . . . . 3.98 110.354 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 50.7 m -64.44 -37.65 88.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.727 -0.67 . . . . 0.7 110.783 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 127' ' ' ILE . 73.5 mt -66.43 -46.01 77.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.35 -0.386 . . . . 1.33 110.88 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.14 -29.82 68.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 0.69 111.021 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.77 -21.77 64.85 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.028 -0.533 . . . . 0.84 111.727 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.421 . . . . 1.12 111.108 179.939 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.417 ' O ' HG22 ' A' ' 10' ' ' THR . 9.8 pt20 . . . . . 0 CA--C 1.527 0.073 0 CA-C-O 120.589 0.233 . . . . 2.75 111.252 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -75.16 -43.0 54.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.979 0.418 . . . . 0.91 110.052 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.97 -39.16 93.85 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.978 -0.556 . . . . 0.86 111.438 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.417 HG22 ' O ' ' A' ' 7' ' ' GLN . 1.2 t -69.83 -24.12 63.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.45 -0.341 . . . . 1.42 110.783 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -71.9 -36.83 70.14 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 109.996 -0.372 . . . . 1.3 109.996 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -68.08 -26.99 66.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.951 -0.568 . . . . 1.57 110.508 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -70.28 -34.34 72.66 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.742 -0.663 . . . . 1.59 110.464 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.6 t -105.2 17.19 24.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.903 -0.59 . . . . 1.63 110.442 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.2 126.88 31.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.863 -0.608 . . . . 1.1 110.291 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -115.29 151.99 33.56 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.663 -0.699 . . . . 2.16 109.557 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -80.19 40.53 0.49 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.506 0.67 . . . . 1.94 111.119 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.532 ' O ' HG12 ' A' ' 22' ' ' ILE . 3.5 m -107.18 146.66 31.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.561 -0.745 . . . . 1.61 110.063 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.1 -32.96 74.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.066 -0.515 . . . . 2.64 110.16 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -66.59 -49.67 65.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.069 -0.514 . . . . 2.99 109.838 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.46 ' OG ' ' HB2' ' A' ' 18' ' ' SER . 1.2 m -56.6 -48.77 76.71 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.905 -0.588 . . . . 1.1 111.777 -179.321 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.532 HG12 ' O ' ' A' ' 18' ' ' SER . 9.4 mm -64.44 -45.8 94.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.577 -0.283 . . . . 0.88 110.979 -179.595 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.7 m -66.4 -39.44 89.03 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 111.827 0.306 . . . . 1.18 111.827 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.0 t -59.64 -47.33 86.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.064 0.459 . . . . 1.16 110.152 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.36 -34.0 72.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.968 -0.56 . . . . 0.45 110.799 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.5 t -59.06 -52.67 64.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.175 -0.466 . . . . 1.32 110.283 179.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.7 mmtp -62.97 -37.95 89.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.093 -0.503 . . . . 2.38 110.395 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 20.6 t90 -61.7 -39.05 90.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.505 -0.77 . . . . 0.98 110.303 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 29' ' ' LEU . 2.2 mm? -74.05 -42.23 60.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.715 -0.675 . . . . 1.3 110.515 179.224 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 mp -59.85 -23.26 63.24 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.093 -0.503 . . . . 1.06 111.585 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 78.3 mt -75.82 -32.04 59.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.458 -0.337 . . . . 1.71 110.528 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -103.08 48.12 0.86 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.58 0.705 . . . . 1.51 110.168 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.442 ' HA ' ' CE2' ' A' ' 79' ' ' PHE . 34.0 p90 -57.89 -23.24 52.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.259 -0.882 . . . . 1.61 112.09 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.7 mtp-105 -71.75 -18.73 62.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.912 0.387 . . . . 3.97 111.143 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.04 21.72 16.86 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.941 0.4 . . . . 1.7 110.817 -179.517 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.478 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.26 -49.45 84.9 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 115.446 -0.797 . . . . 0.43 112.521 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.588 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 35.3 Cg_endo -65.46 -34.56 42.66 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 121.548 1.499 . . . . 0.5 112.745 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.4 ttmt -66.47 -47.04 74.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.677 0.275 . . . . 2.78 111.688 -179.007 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.445 ' HA ' ' SD ' ' A' ' 42' ' ' MET . 26.9 m -73.14 -22.93 19.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 C-N-CA 120.777 -0.369 . . . . 0.39 111.053 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.427 ' HA ' ' CE1' ' A' ' 83' ' ' PHE . . . -71.94 -50.1 31.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.391 -0.368 . . . . 0.32 111.029 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 5.0 pt-20 -63.69 -44.32 94.05 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.347 -0.388 . . . . 1.4 111.283 -179.572 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.445 ' SD ' ' HA ' ' A' ' 39' ' ' VAL . 16.5 ptm -65.88 -33.44 75.85 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.484 0.183 . . . . 1.51 110.915 -179.552 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 64.7 t90 -64.94 -45.49 85.56 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.158 -0.682 . . . . 0.41 109.158 178.566 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.479 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 16.9 ttpt -60.16 -49.5 77.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.277 -0.874 . . . . 1.11 110.426 179.293 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.519 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 6.7 mm-40 -58.48 -42.51 87.71 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.04 0.448 . . . . 1.96 110.58 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -63.66 -42.75 98.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.761 -0.654 . . . . 1.58 111.217 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 71.6 mmm -72.74 -23.6 60.86 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.129 -0.487 . . . . 0.7 112.311 -178.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 71.0 mt -85.27 -16.8 38.92 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 111.942 0.349 . . . . 0.88 111.942 -179.272 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 57.0 mtm180 -70.67 133.85 86.48 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.737 0.304 . . . . 2.69 111.401 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.2 -13.63 20.95 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.858 2.372 . . . . 0.94 112.37 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -9.68 58.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.988 -0.551 . . . . 1.33 110.793 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 34.0 t -104.63 125.81 59.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.796 -0.638 . . . . 0.59 109.743 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -72.74 163.28 28.35 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.057 0.456 . . . . 1.8 111.005 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.22 -34.44 73.66 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.123 0.786 . . . . 0.81 113.123 -178.336 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -62.6 -43.92 97.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.769 0.319 . . . . 3.58 110.68 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -65.28 -37.38 87.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 3.05 110.359 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -65.77 -36.15 82.74 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.908 -0.587 . . . . 0.59 110.327 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 32.9 tp -62.85 -41.32 99.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.125 -0.489 . . . . 1.26 110.032 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.4 mp -69.39 -35.98 76.32 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.03 -0.532 . . . . 1.54 110.16 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.11 -32.46 84.12 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.758 -0.734 . . . . 0.37 111.313 178.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 37.2 tp -68.16 -37.13 80.67 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.97 0.414 . . . . 1.23 110.218 179.039 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -64.57 -39.47 93.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.842 -0.617 . . . . 1.38 110.499 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.0 tp -63.67 -44.61 93.26 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.082 -0.508 . . . . 1.45 110.481 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.429 ' O ' HG22 ' A' ' 68' ' ' VAL . 13.6 tmm? -60.13 -41.58 92.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.013 -0.54 . . . . 0.61 109.763 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.505 ' O ' ' HB2' ' A' ' 69' ' ' GLN . 1.4 t30 -60.05 -41.74 92.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.601 -0.727 . . . . 1.69 111.301 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -67.79 -47.72 68.32 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.114 0.413 . . . . 1.54 112.114 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 31.1 m -63.33 -32.13 55.35 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 112.669 0.618 . . . . 1.4 112.669 -178.072 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.429 HG22 ' O ' ' A' ' 64' ' ' MET . 34.2 m -88.59 -18.96 7.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.613 -0.435 . . . . 0.43 111.09 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.505 ' HB2' ' O ' ' A' ' 65' ' ' ASN . 6.2 tp-100 -76.77 -49.35 16.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 2.02 110.831 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 55.4 mm-40 -82.16 -6.15 58.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.185 -0.461 . . . . 2.1 111.035 -179.018 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.3 -33.47 72.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.317 -0.401 . . . . 0.51 111.519 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -67.02 -28.68 68.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.65 -0.25 . . . . 2.09 111.24 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.56 -38.53 95.83 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.918 -0.658 . . . . 0.66 111.93 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -100.57 0.82 40.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.653 0.263 . . . . 1.62 110.743 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? 63.02 37.75 11.47 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.824 -0.626 . . . . 2.7 111.009 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.4 mm -92.32 81.86 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.367 0.603 . . . . 0.63 109.755 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 44.1 pt -73.78 -11.37 14.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.616 -0.72 . . . . 0.86 111.249 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -61.8 -47.57 84.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.11 -0.496 . . . . 2.22 110.628 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.442 ' CE2' ' HA ' ' A' ' 33' ' ' TYR . 8.7 m-85 -64.92 -33.96 77.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.303 -0.408 . . . . 1.34 111.214 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -71.58 -26.49 62.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.989 -0.551 . . . . 1.3 111.32 -179.119 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -87.26 -41.92 13.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.723 0.297 . . . . 1.32 110.542 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' SER . . . . . 0.457 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 35.0 p -67.3 -52.52 39.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.326 -0.397 . . . . 0.94 111.001 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.427 ' CE1' ' HA ' ' A' ' 40' ' ' ALA . 18.9 m-85 -74.31 -31.54 62.52 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.323 -0.398 . . . . 1.23 110.712 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -63.14 -43.64 98.37 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.166 -0.54 . . . . 0.34 113.39 -179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.457 ' HE2' ' HA ' ' A' ' 82' ' ' SER . 0.1 OUTLIER -65.47 -24.79 67.25 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.254 0.465 . . . . 1.31 112.254 -178.627 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.7 m -104.77 -9.86 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 C-N-CA 120.894 -0.322 . . . . 0.38 111.364 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.22 -48.73 80.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.267 -0.424 . . . . 0.38 111.432 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.04 -41.76 88.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.157 -0.474 . . . . 0.45 111.359 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -62.33 -50.31 72.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.888 -0.596 . . . . 1.56 110.464 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 92.9 t -65.32 -41.31 91.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.957 -0.565 . . . . 0.34 110.936 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -60.87 -48.29 82.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.501 -0.318 . . . . 1.45 111.101 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -64.9 -25.47 70.69 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.589 -0.815 . . . . 0.41 111.879 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.599 ' O ' ' HG2' ' A' ' 96' ' ' GLN . 3.8 mmm-85 -78.87 -51.75 9.26 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.435 0.16 . . . . 3.46 111.21 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 46.2 pt -68.09 -22.26 27.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.926 -0.31 . . . . 0.5 111.241 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -65.51 -28.06 68.92 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.927 0.394 . . . . 1.0 110.742 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.599 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 10.0 pt20 -98.49 -11.84 21.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.031 0.443 . . . . 1.14 110.767 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -91.43 -37.61 13.09 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.153 -0.476 . . . . 1.33 110.628 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -72.99 130.2 85.36 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.265 -0.425 . . . . 1.39 109.933 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -52.55 -77.1 0.02 OUTLIER 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 123.317 2.678 . . . . 1.47 113.298 -179.453 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -155.8 -53.94 0.09 Allowed 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 111.905 0.335 . . . . 4.87 111.905 179.478 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -65.24 -33.38 75.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.038 0.447 . . . . 2.58 110.838 -179.527 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 79.5 mt -74.13 -39.01 63.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.174 -0.466 . . . . 0.85 110.875 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' LYS . . . . . 0.479 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 10.6 ptpt -73.11 -8.75 57.14 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 121.336 0.589 . . . . 2.36 110.392 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -81.05 -10.76 59.64 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.361 -0.836 . . . . 2.57 109.539 178.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -95.26 -30.06 14.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.722 -0.672 . . . . 2.44 111.308 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 103' ' ' LYS . 4.2 pp -69.78 -28.27 65.62 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 121.056 0.455 . . . . 1.27 110.233 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.04 -34.57 76.71 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.979 -0.555 . . . . 1.15 110.126 179.172 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 108' ' ' ARG . 40.0 mmt180 -66.57 -51.62 54.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.556 -0.747 . . . . 3.6 111.051 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.453 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 2.7 p -65.28 -40.26 88.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.423 -0.353 . . . . 1.25 110.699 -179.659 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 6.3 t -62.5 -42.8 97.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.864 0.364 . . . . 1.11 110.046 179.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -59.26 -47.83 83.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.866 -0.607 . . . . 1.74 109.953 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.437 ' O ' ' HG2' ' A' ' 116' ' ' ARG . 96.8 mt -60.7 -49.72 83.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.996 -0.547 . . . . 1.21 111.335 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 96.0 mt -59.87 -39.15 84.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.331 -0.395 . . . . 1.33 111.963 -178.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 4.7 pttp -82.23 -22.93 35.63 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.549 -0.46 . . . . 1.69 111.769 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -78.79 -37.0 41.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.923 0.392 . . . . 2.2 110.48 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 13.4 mmm-85 -84.67 1.37 46.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.083 -0.508 . . . . 3.23 110.288 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 57.79 47.79 14.84 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.435 -0.802 . . . . 2.0 111.034 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 31.6 mm -70.17 -50.45 47.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.907 -0.588 . . . . 0.61 109.801 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -100.38 158.79 15.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.901 -0.591 . . . . 1.26 110.309 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.8 m -67.32 156.02 37.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.194 -0.457 . . . . 1.3 109.945 179.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 61.3 mtpt -55.77 -34.29 65.12 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.945 0.35 . . . . 2.85 111.945 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -59.54 -41.83 90.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.184 0.516 . . . . 2.95 110.02 179.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.429 ' O ' HG13 ' A' ' 127' ' ' ILE . 40.7 t -72.27 -45.01 62.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.578 -0.737 . . . . 1.28 110.301 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 76.8 t -57.87 -44.07 85.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.496 . . . . 1.23 110.932 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 42.4 t-20 -58.01 -45.76 86.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.923 -0.58 . . . . 1.74 110.259 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -62.96 -38.82 92.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.984 -0.553 . . . . 1.44 111.305 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 123' ' ' VAL . 79.9 mt -66.75 -46.67 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.091 0.472 . . . . 0.47 110.775 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 68.5 mt-10 -63.17 -28.86 70.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.151 -0.477 . . . . 2.05 110.952 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 21.5 mtm-85 -81.11 -41.08 23.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.24 -0.437 . . . . 3.98 111.984 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 1.2 p -62.71 -33.72 75.69 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.002 0.43 . . . . 0.7 110.654 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.6 mp -68.5 -44.25 75.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.169 -0.469 . . . . 1.33 110.401 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.84 -37.83 76.29 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.044 -0.526 . . . . 0.69 111.735 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -64.44 -19.43 65.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.936 0.398 . . . . 0.84 111.426 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 116.109 -0.496 . . . . 1.12 111.281 179.793 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.535 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 92.3 mm-40 . . . . . 0 C--O 1.226 -0.165 0 CA-C-O 121.067 0.461 . . . . 2.75 110.644 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.521 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 78.5 t80 -79.93 -42.58 23.77 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.923 -0.581 . . . . 0.91 109.693 179.114 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.1 m -65.34 -34.54 78.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.65 -0.705 . . . . 0.86 111.494 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.07 -35.53 81.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.003 0.43 . . . . 1.42 110.719 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.535 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 31.1 mmmt -76.23 -38.81 55.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.056 -0.52 . . . . 1.3 110.584 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -60.97 -29.03 69.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.25 -0.432 . . . . 1.57 111.499 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 -83.76 -5.97 59.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.309 -0.405 . . . . 1.59 111.855 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.6 t -115.81 -3.27 12.23 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.669 -0.412 . . . . 1.63 111.44 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.408 HD21 ' HB2' ' A' ' 25' ' ' ALA . 32.5 mt -72.93 163.07 28.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.52 -0.309 . . . . 1.1 111.03 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -143.67 -170.26 3.26 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.708 -0.479 . . . . 2.16 109.708 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -76.67 -19.28 57.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.198 0.523 . . . . 1.94 110.379 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.56 116.88 2.91 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.587 -0.733 . . . . 1.61 110.782 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.47 -35.22 65.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.769 -0.651 . . . . 2.64 110.784 -179.485 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -65.7 -34.09 77.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.853 -0.612 . . . . 2.99 110.967 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.5 p -71.41 -40.11 70.69 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.575 -0.528 . . . . 1.1 109.575 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.1 mm -66.59 -44.18 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 CA-C-N 115.91 -0.587 . . . . 0.88 109.77 179.046 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 56.0 m -59.58 -38.01 80.02 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.971 -0.559 . . . . 1.18 111.173 179.464 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.3 m -67.9 -28.69 67.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.809 0.338 . . . . 1.16 110.832 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.408 ' HB2' HD21 ' A' ' 15' ' ' LEU . . . -82.78 -44.26 15.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.255 -0.43 . . . . 0.45 111.113 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.4 p -62.44 -44.01 97.45 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.726 0.298 . . . . 1.32 110.651 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -64.66 -36.96 85.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.982 0.42 . . . . 2.38 110.536 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -67.44 -36.16 80.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.267 0.556 . . . . 0.98 109.539 178.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -70.86 -39.41 72.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.715 -0.675 . . . . 1.3 110.559 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.0 mt -62.28 -24.91 67.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.303 -0.408 . . . . 1.06 110.739 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 24.0 mt -78.55 -16.38 57.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.99 -0.55 . . . . 1.71 111.338 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -120.58 46.5 1.98 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.075 0.464 . . . . 1.51 110.659 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -62.81 -9.69 10.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 1.61 111.386 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 77.5 mtt180 -66.28 -35.42 80.34 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.218 0.532 . . . . 3.97 110.088 178.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -103.79 27.63 7.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.617 -0.719 . . . . 1.7 110.86 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.478 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.51 -51.32 74.15 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.736 -0.665 . . . . 0.43 111.852 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.478 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 33.4 Cg_endo -64.5 -28.64 61.92 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 121.617 1.544 . . . . 0.5 112.089 179.499 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.1 tppt? -72.77 -46.27 54.27 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.023 -0.535 . . . . 2.78 111.185 -179.056 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 35.5 m -72.19 -25.23 23.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 C-N-CA 120.924 -0.311 . . . . 0.39 110.521 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.01 -49.2 62.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 0.32 110.494 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -68.91 -33.87 74.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.986 -0.552 . . . . 1.4 110.098 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.521 ' SD ' ' HB3' ' A' ' 8' ' ' PHE . 39.2 ttm -66.41 -40.05 89.34 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.935 -0.575 . . . . 1.51 109.916 179.123 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 51.5 t90 -62.48 -47.33 84.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.493 -0.776 . . . . 0.41 109.566 178.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 38.9 tttt -56.62 -47.71 79.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.384 -0.826 . . . . 1.11 110.802 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.579 ' O ' ' HG2' ' A' ' 49' ' ' ARG . 12.4 mm-40 -57.95 -44.68 87.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.044 -0.526 . . . . 1.96 111.304 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -66.18 -44.46 83.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 1.58 111.353 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 84.8 mmm -66.32 -29.62 69.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.303 -0.408 . . . . 0.7 111.577 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.2 mt -92.73 19.4 7.55 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.796 0.331 . . . . 0.88 111.365 -179.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.579 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 36.1 mmt-85 -87.08 133.88 38.04 Favored Pre-proline 0 C--N 1.328 -0.353 0 N-CA-C 110.011 -0.366 . . . . 2.69 110.011 178.39 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -74.34 -22.34 16.47 Favored 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.51 2.14 . . . . 0.94 112.397 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.3 m -83.3 -16.18 47.23 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.244 -0.435 . . . . 1.33 111.456 -179.662 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.6 t -77.76 127.36 38.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.122 0.486 . . . . 0.59 110.794 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -66.55 149.13 50.91 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.437 -0.801 . . . . 1.8 111.137 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.48 -39.46 70.43 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.097 0.406 . . . . 0.81 112.097 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 42.0 mtm105 -67.82 -29.73 68.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.877 0.37 . . . . 3.58 110.682 -179.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -69.3 -36.67 77.26 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.642 -0.503 . . . . 3.05 109.642 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 50.8 mttt -70.03 -33.15 71.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.695 -0.684 . . . . 0.59 109.291 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 19.9 tp -62.66 -41.01 98.83 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.667 -0.697 . . . . 1.26 109.811 178.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.9 mp -67.64 -36.99 81.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.468 -0.787 . . . . 1.54 109.997 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.17 -30.19 75.36 Favored Glycine 0 C--N 1.331 0.293 0 CA-C-N 115.802 -0.635 . . . . 0.37 111.604 179.212 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 8.3 mt -63.84 -44.63 92.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.882 0.372 . . . . 1.23 110.216 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -62.56 -39.22 92.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.672 -0.695 . . . . 1.38 110.548 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -61.25 -48.87 79.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.94 -0.573 . . . . 1.45 110.618 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.401 ' O ' HG12 ' A' ' 67' ' ' VAL . 14.7 tmm? -62.38 -48.56 79.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 0.61 110.295 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -58.5 -41.59 85.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.794 -0.639 . . . . 1.69 111.382 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -68.03 -47.72 67.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.157 -0.474 . . . . 1.54 111.612 -179.258 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.401 HG12 ' O ' ' A' ' 64' ' ' MET . 8.2 p -64.28 -36.29 76.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 112.645 0.609 . . . . 1.4 112.645 -177.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 64' ' ' MET . 35.7 m -78.27 -26.07 14.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 C-N-CA 120.726 -0.39 . . . . 0.43 111.28 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -52.07 20.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.018 0.437 . . . . 2.02 109.848 179.409 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 26.6 mm100 -72.27 -15.21 61.91 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.058 -0.519 . . . . 2.1 110.925 -179.626 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.79 -25.68 68.02 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.261 -0.427 . . . . 0.51 110.56 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.507 ' HG2' ' NE2' ' A' ' 80' ' ' GLN . 19.5 mtpt -70.63 -21.04 62.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.335 -0.393 . . . . 2.09 110.443 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.21 -43.69 31.44 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.967 -0.635 . . . . 0.66 112.177 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -91.47 -0.85 57.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.742 0.306 . . . . 1.62 110.616 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp 62.98 46.09 4.99 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.429 -0.805 . . . . 2.7 111.132 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 31.9 mm -95.89 78.7 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.921 -0.582 . . . . 0.63 110.124 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.571 ' HA ' ' OE1' ' A' ' 80' ' ' GLN . 15.4 pt -68.51 -16.3 20.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.713 -0.676 . . . . 0.86 110.295 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -61.48 -37.9 85.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.542 -0.754 . . . . 2.22 110.541 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.43 ' O ' ' HB2' ' A' ' 83' ' ' PHE . 0.8 OUTLIER -72.42 -42.13 65.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.017 -0.538 . . . . 1.34 111.173 -179.406 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.571 ' OE1' ' HA ' ' A' ' 77' ' ' ILE . 21.6 mt-30 -68.94 -27.47 65.77 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.081 -0.509 . . . . 1.3 111.511 -178.82 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.56 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 5.6 t70 -76.02 -49.21 18.23 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.97 0.415 . . . . 1.32 110.125 178.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.7 p -67.64 -49.15 64.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.022 -0.535 . . . . 0.94 111.516 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.43 ' HB2' ' O ' ' A' ' 79' ' ' PHE . 4.4 m-85 -71.36 -30.7 66.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.59 -0.277 . . . . 1.23 111.239 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.85 -52.03 54.93 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.107 -0.568 . . . . 0.34 113.785 -179.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.56 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 10.0 ptpt -60.26 -36.67 78.32 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.072 0.397 . . . . 1.31 112.072 -178.366 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.8 m -82.8 -28.01 8.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 C-N-CA 120.667 -0.413 . . . . 0.38 111.124 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 91' ' ' LEU . . . -62.14 -41.2 98.03 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.639 -0.255 . . . . 0.38 110.934 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.09 -33.9 69.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.028 0.442 . . . . 0.45 111.125 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -83.39 -52.46 6.51 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.909 -0.587 . . . . 1.56 110.873 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.508 ' O ' HG12 ' A' ' 94' ' ' ILE . 75.7 t -57.56 -50.83 75.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.093 -0.503 . . . . 0.34 111.997 -178.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.414 ' HB2' ' O ' ' A' ' 87' ' ' ALA . 8.5 mp -61.52 -38.52 87.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.692 -0.231 . . . . 1.45 111.087 -178.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -70.88 -28.82 70.02 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.506 -0.854 . . . . 0.41 112.005 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.535 ' O ' ' HG2' ' A' ' 96' ' ' GLN . 1.3 mmm-85 -78.02 -51.45 10.32 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.646 0.26 . . . . 3.46 111.063 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.508 HG12 ' O ' ' A' ' 90' ' ' VAL . 32.8 pt -70.78 -15.85 19.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.523 -0.308 . . . . 0.5 111.615 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -58.19 -34.16 70.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.018 0.437 . . . . 1.0 110.675 179.301 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.535 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 4.3 pt20 -96.56 1.74 51.64 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.155 -0.475 . . . . 1.14 110.799 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -100.67 -31.23 11.32 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.15 0.5 . . . . 1.33 109.965 179.098 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -81.67 131.76 56.82 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.518 -0.765 . . . . 1.39 111.11 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -65.1 167.6 15.8 Favored 'Trans proline' 0 CA--C 1.529 0.271 0 C-N-CA 122.699 2.266 . . . . 1.47 111.724 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 13.3 mmm180 -47.82 -40.57 21.51 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.852 0.686 . . . . 4.87 112.852 -179.067 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -71.53 -47.81 52.76 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.002 0.371 . . . . 2.58 112.002 -179.147 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 30.7 mt -70.94 -39.59 72.54 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.857 0.317 . . . . 0.85 111.857 -178.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' LYS . . . . . 0.405 ' HB2' ' HE3' ' A' ' 103' ' ' LYS . 15.3 ptmt -71.15 -17.73 62.54 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.766 -0.374 . . . . 2.36 110.629 -179.512 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -67.22 -34.38 77.35 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.182 -1.044 . . . . 2.57 108.182 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.42 ' O ' HG23 ' A' ' 109' ' ' VAL . 74.0 mmtt -76.49 -37.05 57.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.178 -0.919 . . . . 2.44 109.064 178.359 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 35.4 tp -59.58 -37.58 78.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.549 -0.75 . . . . 1.27 109.974 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.556 ' O ' ' HB2' ' A' ' 111' ' ' ASN . 36.7 m -61.04 -37.48 82.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.619 -0.719 . . . . 1.15 110.328 179.259 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.9 mtt180 -70.24 -38.19 75.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 3.6 110.555 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.443 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 61.8 t -60.9 -57.2 13.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.039 -0.528 . . . . 1.25 110.719 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.445 ' HA ' HD12 ' A' ' 113' ' ' LEU . 10.8 p -65.18 -28.97 45.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.182 -0.463 . . . . 1.11 111.054 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.556 ' HB2' ' O ' ' A' ' 107' ' ' SER . 56.0 t30 -60.33 -55.71 30.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.248 -0.433 . . . . 1.74 110.307 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 95.7 mt -62.95 -36.19 74.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.092 -0.504 . . . . 1.21 111.154 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.445 HD12 ' HA ' ' A' ' 110' ' ' VAL . 71.5 mt -56.36 -42.8 78.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.363 -0.38 . . . . 1.33 111.764 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.78 -29.32 19.86 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.816 -0.353 . . . . 1.69 111.372 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -65.57 -38.55 89.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.764 0.316 . . . . 2.2 111.561 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 7.9 mmm180 -96.11 5.61 50.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.347 -0.388 . . . . 3.23 111.012 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.0 m120 52.22 57.75 6.13 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.391 0.615 . . . . 2.0 110.901 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 43.2 mm -76.13 -33.63 24.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.552 -0.749 . . . . 0.61 110.286 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' PHE . . . . . 0.432 ' HE2' HD13 ' A' ' 113' ' ' LEU . 80.5 m-85 -110.47 171.91 7.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.776 -0.647 . . . . 1.26 110.811 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.0 t -69.65 146.98 51.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.744 -0.662 . . . . 1.3 109.932 179.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 50.7 pttt -59.47 -27.48 66.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.759 0.281 . . . . 2.85 111.759 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -68.78 -44.23 74.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.842 0.353 . . . . 2.95 110.817 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.54 ' O ' HG13 ' A' ' 127' ' ' ILE . 9.1 p -82.47 -28.42 8.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.416 -0.356 . . . . 1.28 110.912 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 7.3 t -61.26 -43.22 96.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 109.633 -0.506 . . . . 1.23 109.633 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -64.7 -35.43 81.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.674 -0.694 . . . . 1.74 109.963 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -63.57 -41.26 98.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.872 -0.604 . . . . 1.44 110.219 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ILE . . . . . 0.54 HG13 ' O ' ' A' ' 123' ' ' VAL . 63.6 mt -62.73 -53.99 39.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.799 -0.637 . . . . 0.47 111.334 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -63.55 -36.54 84.12 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 120.994 -0.282 . . . . 2.05 111.08 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -61.98 -39.74 93.22 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.847 -0.427 . . . . 3.98 109.847 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 44.6 m -67.53 -39.77 85.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.916 -0.583 . . . . 0.7 110.493 179.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.0 mt -69.16 -29.45 67.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.094 -0.503 . . . . 1.33 110.927 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -78.78 -37.79 40.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.197 -0.456 . . . . 0.69 110.503 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.02 -19.26 62.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.829 -0.623 . . . . 0.84 111.782 -179.467 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.432 -0.349 . . . . 1.12 111.072 -179.85 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 . . . . . 0 CA--C 1.531 0.22 0 CA-C-O 120.926 0.393 . . . . 2.75 111.724 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -68.54 -42.56 78.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.05 0.452 . . . . 0.91 111.206 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.92 -42.49 94.04 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.964 0.727 . . . . 0.86 112.964 -178.57 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.11 -21.92 61.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.61 0.243 . . . . 1.42 111.385 -179.131 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -69.49 -36.74 76.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.74 0.305 . . . . 1.3 110.42 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -64.97 -28.88 69.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.236 0.541 . . . . 1.57 110.708 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -78.9 -10.59 59.86 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.673 -0.694 . . . . 1.59 110.919 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.59 36.28 4.64 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.171 0.51 . . . . 1.63 111.155 -179.529 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 15' ' ' LEU . 13.9 mt -112.36 163.2 14.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.051 0.453 . . . . 1.1 111.286 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -134.06 160.77 36.76 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.571 -0.74 . . . . 2.16 109.133 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -79.82 29.31 0.26 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.777 0.323 . . . . 1.94 111.701 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.535 ' HB2' ' OG ' ' A' ' 21' ' ' SER . 68.6 m -93.32 140.95 28.99 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.179 -0.304 . . . . 1.61 110.179 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.49 -52.86 63.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.121 -0.491 . . . . 2.64 110.333 -179.342 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -61.48 -40.77 95.76 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.908 -0.587 . . . . 2.99 111.775 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.535 ' OG ' ' HB2' ' A' ' 18' ' ' SER . 18.1 m -59.25 -49.1 79.13 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.765 0.316 . . . . 1.1 110.968 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.1 mm -64.1 -41.91 93.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.726 -0.472 . . . . 0.88 109.726 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.6 m -59.04 -40.88 86.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.928 -0.578 . . . . 1.18 111.01 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.3 m -61.26 -47.16 87.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 1.16 110.825 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.38 -42.0 79.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.347 -0.388 . . . . 0.45 111.052 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 19.1 m -62.7 -36.64 83.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.28 -0.418 . . . . 1.32 111.244 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.9 ttpt -61.24 -40.91 95.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.811 0.339 . . . . 2.38 110.532 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 33.1 t90 -68.59 -38.24 80.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.955 0.407 . . . . 0.98 109.916 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -64.12 -41.06 97.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.796 -0.638 . . . . 1.3 110.756 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.66 -33.24 73.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.119 -0.491 . . . . 1.06 110.732 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 74.8 mt -73.04 -25.18 60.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.968 -0.56 . . . . 1.71 110.308 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 70.9 mm-40 -97.93 48.42 1.01 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.044 -0.525 . . . . 1.51 110.613 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.452 ' HA ' ' CZ ' ' A' ' 79' ' ' PHE . 6.6 p90 -59.71 -21.31 60.44 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.681 -0.69 . . . . 1.61 111.614 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -75.64 -14.77 60.38 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.28 -0.418 . . . . 3.97 111.363 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -109.44 12.72 24.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.778 0.323 . . . . 1.7 110.899 -179.572 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.463 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -51.45 -51.02 73.17 Favored Pre-proline 0 CA--C 1.538 0.483 0 CA-C-N 115.903 -0.59 . . . . 0.43 112.414 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 39.3 Cg_endo -66.07 -19.92 57.19 Favored 'Trans proline' 0 C--N 1.357 0.978 0 C-N-CA 121.888 1.725 . . . . 0.5 112.831 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.7 tptm -88.28 -46.26 9.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.672 0.272 . . . . 2.78 110.821 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.2 m -67.44 -28.36 41.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.964 -0.294 . . . . 0.39 110.854 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.98 -46.77 80.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.362 -0.381 . . . . 0.32 111.337 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -70.41 -38.09 74.56 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.891 -0.324 . . . . 1.4 110.454 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 68.8 mtm -63.12 -41.91 99.42 Favored 'General case' 0 CA--C 1.521 -0.168 0 N-CA-C 109.98 -0.378 . . . . 1.51 109.98 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 71.1 t90 -61.95 -48.57 79.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.616 -0.72 . . . . 0.41 110.256 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.509 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 16.1 ttpt -58.71 -49.51 77.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.807 -0.633 . . . . 1.11 110.65 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.486 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 57.7 mm-40 -60.85 -42.3 97.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.886 -0.597 . . . . 1.96 111.087 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 76.3 t80 -62.65 -47.7 82.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.104 -0.498 . . . . 1.58 111.109 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 74.6 mmm -64.55 -20.8 66.45 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.26 -0.427 . . . . 0.7 111.988 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 64.0 mt -97.63 0.12 46.67 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.626 0.232 . . . . 0.88 111.626 -179.337 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.486 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 27.0 mtp180 -79.03 135.64 58.42 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.628 0.251 . . . . 2.69 110.528 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.12 5.95 3.28 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.909 2.406 . . . . 0.94 112.81 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.1 m -103.22 8.23 38.46 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.097 -0.501 . . . . 1.33 110.347 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.5 t -111.54 123.6 67.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.984 -0.553 . . . . 0.59 111.065 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -73.3 153.7 40.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.0 -0.545 . . . . 1.8 110.641 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.09 -32.56 62.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 0.81 112.193 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -42.37 98.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.875 0.369 . . . . 3.58 110.79 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.9 mtm-85 -71.57 -29.8 65.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.246 -0.434 . . . . 3.05 110.617 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 54.2 mttt -65.28 -34.43 78.33 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.334 -0.617 . . . . 0.59 109.334 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 21.4 tp -67.53 -41.25 84.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.803 -0.635 . . . . 1.26 109.315 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.7 mp -63.75 -44.83 92.32 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.291 -0.868 . . . . 1.54 110.032 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.16 -35.39 91.46 Favored Glycine 0 C--N 1.333 0.383 0 CA-C-N 115.845 -0.616 . . . . 0.37 111.949 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.36 -44.31 91.82 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.666 -0.494 . . . . 1.23 109.666 179.011 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -65.81 -34.47 78.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.801 -0.636 . . . . 1.38 111.114 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 39.3 tp -63.84 -44.14 94.07 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.76 -0.459 . . . . 1.45 109.76 178.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.449 ' O ' HG22 ' A' ' 68' ' ' VAL . 15.8 tmm? -64.97 -44.32 89.77 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.688 -0.687 . . . . 0.61 109.897 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -57.67 -39.7 77.68 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.817 -0.628 . . . . 1.69 110.999 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -67.04 -52.73 38.62 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.081 -0.509 . . . . 1.54 111.44 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 31.5 m -63.18 -34.89 69.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 112.817 0.673 . . . . 1.4 112.817 -178.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.449 HG22 ' O ' ' A' ' 64' ' ' MET . 34.6 m -78.5 -24.77 13.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 C-N-CA 120.276 -0.57 . . . . 0.43 110.969 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -76.74 -45.81 27.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.155 0.502 . . . . 2.02 109.953 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -75.29 -16.36 60.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.617 -0.719 . . . . 2.1 110.819 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.47 -33.99 73.38 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 116.06 -0.518 . . . . 0.51 110.682 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.555 ' HG2' HE22 ' A' ' 80' ' ' GLN . 1.8 mmtp -68.35 -27.32 66.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 2.09 110.347 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.01 -46.37 73.77 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.932 -0.576 . . . . 0.66 111.801 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -87.38 -6.56 58.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.981 0.42 . . . . 1.62 110.352 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.88 27.17 9.09 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.25 -0.886 . . . . 2.7 111.668 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.7 mm -94.44 87.71 2.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 109.343 -0.614 . . . . 0.63 109.343 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 18.2 pt -72.33 -8.8 12.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.901 -0.59 . . . . 0.86 111.796 -178.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -60.16 -33.38 72.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.918 0.389 . . . . 2.22 110.388 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.452 ' CZ ' ' HA ' ' A' ' 33' ' ' TYR . 29.7 m-85 -69.04 -48.72 62.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.873 -0.603 . . . . 1.34 109.615 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.555 HE22 ' HG2' ' A' ' 72' ' ' LYS . 86.0 mt-30 -65.19 -32.13 73.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.301 -0.863 . . . . 1.3 111.553 -179.066 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.501 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 9.5 t70 -72.74 -53.64 11.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.834 0.349 . . . . 1.32 110.406 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.4 m -63.65 -42.58 98.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.062 -0.517 . . . . 0.94 111.774 -179.054 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -78.35 -29.19 47.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.616 -0.265 . . . . 1.23 110.977 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -64.95 -41.65 97.26 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 121.049 -0.596 . . . . 0.34 113.346 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.501 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 12.8 ptpt -68.82 -18.34 64.15 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.042 0.386 . . . . 1.31 112.042 -178.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 32.6 m -107.95 -19.91 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 121.008 -0.277 . . . . 0.38 111.222 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.13 95.6 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.431 -0.35 . . . . 0.38 110.96 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.73 -44.2 73.33 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.077 -0.511 . . . . 0.45 110.624 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.411 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 35.4 tp10 -63.68 -58.72 6.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.601 -0.727 . . . . 1.56 110.208 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.485 ' O ' HG12 ' A' ' 94' ' ' ILE . 80.7 t -54.03 -50.27 55.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.761 -0.654 . . . . 0.34 111.994 -179.14 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 81.7 mt -60.97 -42.5 98.42 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.641 0.237 . . . . 1.45 111.641 -179.173 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -67.86 -25.02 74.33 Favored Glycine 0 CA--C 1.519 0.318 0 C-N-CA 120.718 -0.753 . . . . 0.41 112.241 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.411 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 33.5 mmm-85 -83.31 -55.05 4.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.641 0.258 . . . . 3.46 111.213 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.485 HG12 ' O ' ' A' ' 90' ' ' VAL . 30.6 pt -66.38 -19.8 26.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 112.359 0.503 . . . . 0.5 112.359 -178.32 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.1 t30 -63.45 -24.27 67.76 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.256 0.551 . . . . 1.0 110.31 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -90.74 -14.1 32.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.058 -0.519 . . . . 1.14 110.73 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -101.91 -28.69 12.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.03 -0.532 . . . . 1.33 111.048 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -70.26 121.76 84.21 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.166 -0.47 . . . . 1.39 111.411 -179.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -68.64 175.91 6.54 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.417 2.078 . . . . 1.47 111.822 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 13.5 ptt-85 -53.02 -27.67 20.53 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.052 -0.522 . . . . 4.87 112.106 -179.237 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -76.37 -48.42 19.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.028 0.442 . . . . 2.58 111.776 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 22.3 mt -76.7 -35.36 57.93 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.737 0.643 . . . . 0.85 112.737 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 6.0 pttp -64.89 -25.22 67.8 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.733 -0.387 . . . . 2.36 110.993 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' A' ' 100' ' ' ARG . 47.6 mtmt -66.31 -37.74 86.08 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.221 -0.659 . . . . 2.57 109.221 178.1 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -75.68 -34.26 60.42 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.162 -0.926 . . . . 2.44 109.798 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 7.0 tt -63.79 -41.99 97.82 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.417 -0.81 . . . . 1.27 109.985 178.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 21.0 m -62.58 -32.5 73.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.126 -0.488 . . . . 1.15 110.611 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 70.6 mtt180 -67.17 -55.43 14.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.028 -0.533 . . . . 3.6 111.286 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 7.7 p -62.48 -42.5 95.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.307 -0.406 . . . . 1.25 111.983 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.72 -40.56 82.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 120.836 0.35 . . . . 1.11 110.555 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.458 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 11.9 t-20 -61.28 -48.56 80.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.867 -0.606 . . . . 1.74 110.637 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 63.3 mt -61.12 -46.71 96.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.281 -0.418 . . . . 1.21 111.347 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 96.3 mt -59.12 -42.49 90.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.094 -0.503 . . . . 1.33 112.291 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 111' ' ' ASN . 1.2 ptpt -78.48 -33.31 48.31 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.054 0.39 . . . . 1.69 112.054 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -75.62 -39.2 58.19 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.906 0.336 . . . . 2.2 111.906 -178.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -79.96 -1.15 38.24 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.033 0.444 . . . . 3.23 110.801 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 60.8 50.76 5.18 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.589 -0.732 . . . . 2.0 111.454 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 45.9 mm -72.47 -40.6 63.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.091 0.472 . . . . 0.61 110.235 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -109.52 173.85 6.13 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.938 -0.574 . . . . 1.26 109.835 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.78 162.69 29.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.175 -0.466 . . . . 1.3 110.863 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 15.2 mmmt -52.74 -50.27 63.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.17 -0.468 . . . . 2.85 111.292 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -56.37 -34.45 66.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.843 -0.617 . . . . 2.95 112.072 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 61.6 t -80.14 -49.58 18.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.793 0.294 . . . . 1.28 111.793 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 34.7 m -62.63 -29.74 47.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 C-N-CA 120.964 -0.294 . . . . 1.23 111.159 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -78.92 -27.16 43.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.931 0.395 . . . . 1.74 110.819 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.48 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 44.8 t0 -76.63 -41.25 46.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.267 0.556 . . . . 1.44 109.959 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 96.3 mt -60.08 -50.97 78.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.826 -0.624 . . . . 0.47 111.42 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -65.65 -37.39 86.41 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.123 0.416 . . . . 2.05 112.123 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.48 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 33.2 ptt180 -69.63 -26.03 64.22 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 120.761 -0.376 . . . . 3.98 110.785 -179.506 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 49.3 m -68.36 -39.18 81.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.294 0.568 . . . . 0.7 109.684 178.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.8 mp -67.39 -41.93 84.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.735 -0.666 . . . . 1.33 110.123 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.06 -34.9 77.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.795 -0.638 . . . . 0.69 111.043 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -73.14 -25.08 60.69 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.825 0.345 . . . . 0.84 111.086 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.403 0 CA-C-N 116.513 -0.312 . . . . 1.12 110.992 179.769 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.587 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 48.8 mt-30 . . . . . 0 N--CA 1.458 -0.062 0 CA-C-O 120.875 0.369 . . . . 2.75 110.08 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.574 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 70.3 t80 -59.11 -48.97 79.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.73 -0.668 . . . . 0.91 110.508 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.0 -39.08 88.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.889 -0.596 . . . . 0.86 111.039 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -64.99 -32.49 74.24 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 115.889 -0.596 . . . . 1.42 111.197 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 27.6 mmmt -76.49 -40.72 49.45 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 121.065 -0.254 . . . . 1.3 110.589 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.15 -39.78 91.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.067 -0.515 . . . . 1.57 111.381 -179.38 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -76.11 -1.96 28.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.425 -0.352 . . . . 1.59 111.599 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.7 m -126.93 32.39 5.12 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.586 0.708 . . . . 1.63 110.155 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 15' ' ' LEU . 14.6 mt -111.75 168.1 9.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.683 -0.69 . . . . 1.1 111.162 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.541 ' HG2' ' H ' ' A' ' 17' ' ' ASP . 11.1 tt0 -137.9 173.72 11.33 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.551 -0.907 . . . . 2.16 108.551 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.541 ' H ' ' HG2' ' A' ' 16' ' ' GLU . 4.6 p30 -79.78 16.43 1.14 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.768 0.318 . . . . 1.94 111.665 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.413 ' O ' HG12 ' A' ' 22' ' ' ILE . 0.0 OUTLIER -82.07 132.67 35.25 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.832 -0.433 . . . . 1.61 109.832 178.885 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.45 ' HG2' ' N ' ' A' ' 20' ' ' GLU . 16.5 pm0 -62.94 -39.21 93.93 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.019 0.377 . . . . 2.64 112.019 -178.33 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.45 ' N ' ' HG2' ' A' ' 19' ' ' GLN . 5.9 tp10 -71.31 -25.62 62.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.995 0.426 . . . . 2.99 110.152 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 66.8 m -71.21 -44.32 65.63 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.9 -0.778 . . . . 1.1 108.9 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 18' ' ' SER . 47.2 mm -65.29 -45.09 94.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 108.69 -0.856 . . . . 0.88 108.69 178.3 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.8 t -54.86 -43.81 73.42 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.208 -0.905 . . . . 1.18 110.884 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.8 t -58.45 -43.51 88.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 1.16 110.857 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.9 -45.15 59.78 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.266 -0.424 . . . . 0.45 110.989 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 34.4 m -59.8 -40.65 89.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.325 -0.398 . . . . 1.32 111.306 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.57 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 8.2 mptt -56.97 -43.97 82.15 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.085 0.469 . . . . 2.38 110.273 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 24.2 t90 -68.93 -36.68 78.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.674 -0.694 . . . . 0.98 110.454 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -66.85 -43.64 83.1 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.193 -0.458 . . . . 1.3 110.91 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.4 mt -60.3 -27.41 67.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.071 -0.513 . . . . 1.06 111.793 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 77.8 mt -68.37 -39.09 81.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.934 0.397 . . . . 1.71 111.109 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.423 ' H ' ' HG2' ' A' ' 32' ' ' GLN . 9.5 pt20 -95.28 56.77 1.92 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.454 0.645 . . . . 1.51 110.716 -179.617 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.408 ' HA ' ' CE2' ' A' ' 79' ' ' PHE . 36.5 p90 -64.51 -17.24 63.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.476 -0.784 . . . . 1.61 111.557 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 34' ' ' ARG . 9.3 ttp180 -79.9 -3.7 49.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.831 0.348 . . . . 3.97 111.229 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.45 22.18 12.23 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.073 0.463 . . . . 1.7 110.05 179.301 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.459 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.05 -51.75 68.39 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.253 -0.885 . . . . 0.43 112.274 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.46 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 24.1 Cg_endo -62.77 -33.06 77.58 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 121.721 1.614 . . . . 0.5 112.521 179.307 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -46.73 72.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.334 -0.394 . . . . 2.78 111.059 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.2 m -74.56 -25.72 19.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.684 -0.406 . . . . 0.39 110.728 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.05 -49.99 65.74 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.359 -0.382 . . . . 0.32 110.769 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 4.1 pt-20 -66.71 -35.94 81.31 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.328 -0.396 . . . . 1.4 110.258 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.574 ' SD ' ' HB3' ' A' ' 8' ' ' PHE . 16.3 ttm -65.18 -40.67 94.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.095 -0.502 . . . . 1.51 109.946 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 67.4 t90 -63.78 -48.03 78.53 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.793 -0.64 . . . . 0.41 109.645 178.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.8 ttpt -59.75 -46.89 87.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.785 -0.643 . . . . 1.11 110.396 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.548 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 0.8 OUTLIER -59.72 -47.14 86.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.989 -0.55 . . . . 1.96 110.526 179.798 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -61.37 -49.64 76.11 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.714 -0.675 . . . . 1.58 111.549 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 89.0 mmm -63.4 -28.38 69.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.376 -0.374 . . . . 0.7 111.937 -179.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 73.6 mt -97.89 22.48 9.2 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 111.648 0.24 . . . . 0.88 111.648 -179.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 11.2 mtp180 -101.18 139.22 20.28 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.722 0.296 . . . . 2.69 110.689 179.185 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.26 -1.81 11.47 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 123.128 2.552 . . . . 0.94 112.789 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.15 17.34 21.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.998 -0.546 . . . . 1.33 110.751 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 24.2 t -123.32 114.8 43.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.082 -0.508 . . . . 0.59 111.15 -179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -67.23 159.65 28.66 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.93 -0.577 . . . . 1.8 110.02 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.35 -37.9 73.3 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.54 0.57 . . . . 0.81 112.54 -178.799 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -40.94 95.53 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.604 0.24 . . . . 3.58 110.613 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.1 mtm-85 -70.56 -36.46 73.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.407 -0.36 . . . . 3.05 110.465 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -65.37 -37.37 86.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.419 0.628 . . . . 0.59 109.369 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 19.2 tp -64.08 -36.81 85.23 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.585 -0.734 . . . . 1.26 109.595 178.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.3 mp -68.21 -39.37 82.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.41 -0.814 . . . . 1.54 109.819 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.29 -32.95 85.9 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 111.452 -0.659 . . . . 0.37 111.452 179.012 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.431 HD21 HD21 ' A' ' 91' ' ' LEU . 0.4 OUTLIER -67.24 -40.19 86.29 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.431 -0.581 . . . . 1.23 109.431 178.643 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -60.35 -44.57 95.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.555 -0.748 . . . . 1.38 110.264 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 12.4 tp -63.25 -43.9 96.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.004 -0.544 . . . . 1.45 110.701 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.439 ' O ' HG22 ' A' ' 68' ' ' VAL . 12.7 tmm? -59.86 -49.62 76.98 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.006 -0.543 . . . . 0.61 110.392 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -59.25 -42.69 91.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.062 0.458 . . . . 1.69 110.325 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 40.5 t-80 -61.99 -53.82 50.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.708 -0.678 . . . . 1.54 112.1 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 35.8 m -62.05 -37.45 78.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 N-CA-C 112.89 0.7 . . . . 1.4 112.89 -177.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.439 HG22 ' O ' ' A' ' 64' ' ' MET . 33.0 m -79.06 -27.04 13.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 120.368 -0.533 . . . . 0.43 111.44 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -72.12 -49.06 39.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.995 0.426 . . . . 2.02 109.854 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -71.44 -20.21 62.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.805 -0.634 . . . . 2.1 110.614 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.1 -21.54 66.57 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.052 -0.522 . . . . 0.51 111.201 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.87 -31.47 69.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.775 0.322 . . . . 2.09 110.298 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -75.89 -40.78 29.8 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.632 -0.794 . . . . 0.66 111.232 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -79.52 -12.63 59.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.71 -0.245 . . . . 1.62 110.555 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 41.1 mttp 65.27 34.07 8.67 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 123.658 0.599 . . . . 2.7 110.93 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 27.0 mm -93.06 85.55 2.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.043 -0.526 . . . . 0.63 110.264 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 19.5 pt -69.95 -24.89 26.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.761 -0.654 . . . . 0.86 110.999 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.83 -35.47 74.81 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.104 -0.498 . . . . 2.22 110.713 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.408 ' CE2' ' HA ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -69.75 -49.13 56.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.249 -0.432 . . . . 1.34 110.333 179.633 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -63.31 -35.64 81.04 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.482 -0.781 . . . . 1.3 111.027 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.547 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 17.3 t70 -66.53 -51.11 60.19 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.081 0.467 . . . . 1.32 110.544 179.239 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.8 m -63.24 -42.28 99.2 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.447 -0.797 . . . . 0.94 111.84 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -77.87 -35.09 51.32 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.965 -0.294 . . . . 1.23 111.334 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.84 -40.89 98.87 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 121.393 -0.432 . . . . 0.34 113.845 -178.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.547 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 14.3 ptpt -65.98 -24.27 66.75 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 117.148 0.474 . . . . 1.31 112.234 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.2 m -105.1 -15.13 8.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 C-N-CA 120.914 -0.314 . . . . 0.38 111.022 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.73 -49.99 74.21 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.193 -0.458 . . . . 0.38 111.215 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.1 -41.61 75.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.496 . . . . 0.45 111.04 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.555 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 4.8 tp10 -62.62 -60.07 4.03 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.753 -0.658 . . . . 1.56 110.449 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.512 ' O ' HG12 ' A' ' 94' ' ' ILE . 72.6 t -56.45 -49.22 78.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.728 -0.669 . . . . 0.34 111.835 -178.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.431 HD21 HD21 ' A' ' 61' ' ' LEU . 54.4 mt -58.63 -38.32 77.82 Favored 'General case' 0 C--N 1.331 -0.22 0 O-C-N 123.146 0.279 . . . . 1.45 111.532 -179.146 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -70.6 -28.89 70.3 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.703 -0.761 . . . . 0.41 112.72 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.555 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 23.9 mmm-85 -83.44 -49.62 9.12 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 122.857 -0.202 . . . . 3.46 111.3 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.512 HG12 ' O ' ' A' ' 90' ' ' VAL . 20.8 pt -66.09 -20.37 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 N-CA-C 111.988 0.366 . . . . 0.5 111.988 -178.716 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -63.1 -28.16 69.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.333 0.587 . . . . 1.0 109.937 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -88.67 -13.21 40.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.724 -0.671 . . . . 1.14 110.738 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -97.1 -38.03 9.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.968 -0.56 . . . . 1.33 111.147 -179.073 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 14.0 m-30 -72.8 125.94 90.9 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 116.424 -0.353 . . . . 1.39 110.932 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.48 177.44 3.96 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.554 2.169 . . . . 1.47 112.029 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 13.8 ptt-85 -52.61 -36.05 55.57 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 112.862 0.69 . . . . 4.87 112.862 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ASP . . . . . 0.481 ' HA ' ' HE2' ' A' ' 104' ' ' LYS . 1.3 m-20 -76.66 -25.28 53.55 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.741 0.645 . . . . 2.58 112.741 -178.359 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 14.9 mt -93.37 -31.18 14.75 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.868 -0.333 . . . . 0.85 110.972 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' LYS . . . . . 0.523 ' HA ' HD23 ' A' ' 106' ' ' LEU . 32.0 pttt -63.14 -31.61 72.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.456 -0.338 . . . . 2.36 111.134 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.481 ' HE2' ' HA ' ' A' ' 101' ' ' ASP . 51.3 mtmt -64.43 -37.92 89.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.053 0.454 . . . . 2.57 110.302 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.6 mttm -70.46 -40.97 73.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.843 -0.617 . . . . 2.44 109.852 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.523 HD23 ' HA ' ' A' ' 103' ' ' LYS . 0.1 OUTLIER -65.31 -35.91 82.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.955 -0.566 . . . . 1.27 109.728 178.877 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 65.1 m -62.89 -37.18 85.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.185 -0.461 . . . . 1.15 110.362 178.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 39.1 mtt180 -65.05 -36.52 84.6 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 109.847 -0.427 . . . . 3.6 109.847 179.161 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 49.1 t -67.37 -49.76 68.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.991 -0.55 . . . . 1.25 110.013 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 71.0 t -59.16 -37.1 66.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.208 0.527 . . . . 1.11 110.043 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -60.12 -59.61 5.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.342 -0.844 . . . . 1.74 111.06 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.7 tt -61.41 -34.31 60.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 N-CA-C 111.847 0.314 . . . . 1.21 111.847 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 73.6 mt -63.09 -49.98 72.32 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.931 0.345 . . . . 1.33 111.931 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.6 ptpt -82.56 -29.1 30.54 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.07 0.396 . . . . 1.69 112.07 -178.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -67.18 -41.9 85.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.715 0.293 . . . . 2.2 110.908 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -90.8 3.69 53.72 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.529 -0.305 . . . . 3.23 110.523 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 51.27 59.28 4.71 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.618 -0.719 . . . . 2.0 111.059 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 46.6 mm -73.89 -38.75 50.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.677 -0.692 . . . . 0.61 109.888 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -107.15 169.52 8.51 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.691 -0.686 . . . . 1.26 109.569 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.52 157.67 19.83 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 123.27 0.356 . . . . 1.3 110.517 179.285 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.405 ' HA ' HG22 ' A' ' 124' ' ' VAL . 0.0 OUTLIER -57.25 -35.39 69.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.506 -0.315 . . . . 2.85 111.429 -178.963 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -68.11 -37.01 80.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.826 0.346 . . . . 2.95 110.764 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 58.5 t -70.46 -47.11 67.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.326 -0.397 . . . . 1.28 110.88 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.405 HG22 ' HA ' ' A' ' 121' ' ' LYS . 27.5 m -66.21 -24.31 33.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.982 0.42 . . . . 1.23 110.43 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.27 -20.57 47.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.879 -0.601 . . . . 1.74 110.241 179.031 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.504 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 20.3 t0 -83.87 -39.57 19.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.421 0.629 . . . . 1.44 109.721 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 63.1 mt -61.93 -46.5 96.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.701 -0.681 . . . . 0.47 110.91 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -66.36 -37.85 86.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.431 -0.35 . . . . 2.05 111.764 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 30.5 ptt180 -68.93 -39.57 79.53 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.84 -0.344 . . . . 3.98 110.741 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 48.7 m -70.24 -35.37 73.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.948 0.404 . . . . 0.7 110.794 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.9 -45.6 81.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.181 -0.463 . . . . 1.33 110.266 179.269 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.83 -39.15 69.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.726 -0.67 . . . . 0.69 111.535 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.27 -31.68 72.3 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.82 0.343 . . . . 0.84 111.498 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.098 -0.501 . . . . 1.12 111.589 -179.869 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 . . . . . 0 C--O 1.226 -0.151 0 CA-C-O 121.074 0.464 . . . . 2.75 110.874 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -91.37 -38.05 12.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.961 -0.563 . . . . 0.91 110.634 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.84 -44.26 94.16 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.731 -0.668 . . . . 0.86 112.487 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 4.5 t -68.33 -26.85 65.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.645 0.259 . . . . 1.42 111.236 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.516 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 29.8 mmmt -68.8 -36.15 77.9 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 120.805 0.336 . . . . 1.3 110.146 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 42.9 mt -67.54 -34.84 77.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.913 -0.585 . . . . 1.57 110.669 179.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 -70.12 -31.28 68.74 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.75 -0.659 . . . . 1.59 111.621 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.5 t -104.09 16.52 26.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.751 0.31 . . . . 1.63 111.81 -179.123 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 8.1 mt -73.73 176.4 6.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.101 0.477 . . . . 1.1 111.342 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.46 ' HG2' ' H ' ' A' ' 17' ' ' ASP . 5.6 tt0 -146.25 168.8 20.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.715 -0.675 . . . . 2.16 109.552 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.46 ' H ' ' HG2' ' A' ' 16' ' ' GLU . 5.2 p-10 -84.16 10.26 10.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.193 0.521 . . . . 1.94 110.089 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.471 ' O ' HG12 ' A' ' 22' ' ' ILE . 1.4 t -77.16 129.04 35.45 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.509 -0.769 . . . . 1.61 110.53 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -65.34 -33.2 75.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.494 0.664 . . . . 2.64 109.841 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -66.93 -46.43 74.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.986 -1.006 . . . . 2.99 111.096 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.6 p -69.14 -39.48 78.83 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 121.071 -0.252 . . . . 1.1 111.46 -179.426 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 18' ' ' SER . 39.7 mm -59.25 -45.24 93.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 120.765 0.317 . . . . 0.88 110.383 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 t -63.97 -29.91 71.03 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.175 -0.466 . . . . 1.18 110.531 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.0 m -68.62 -31.12 70.06 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.134 -0.485 . . . . 1.16 110.399 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.15 -44.88 28.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.921 -0.582 . . . . 0.45 110.681 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.7 p -64.96 -33.18 75.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.313 -0.403 . . . . 1.32 110.673 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.438 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -63.1 -33.15 74.83 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.256 -0.429 . . . . 2.38 110.734 179.374 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 17.4 t90 -79.87 -34.51 39.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.05 0.452 . . . . 0.98 109.946 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.1 mp -63.78 -41.23 97.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.989 -0.55 . . . . 1.3 110.923 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.59 -21.08 66.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.459 -0.337 . . . . 1.06 111.803 -179.571 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 79.1 mt -76.24 -32.23 58.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.837 0.351 . . . . 1.71 110.634 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -105.19 59.8 0.68 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.671 0.748 . . . . 1.51 109.791 179.377 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 28.1 p90 -60.85 -21.34 63.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.137 -0.938 . . . . 1.61 111.831 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 66.7 mtt180 -77.86 -12.35 59.97 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.075 0.464 . . . . 3.97 110.506 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.34 7.09 44.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.044 -0.525 . . . . 1.7 110.492 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.466 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -51.31 -52.57 58.02 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-N 115.518 -0.765 . . . . 0.43 112.316 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 21.7 Cg_endo -61.76 -31.71 85.93 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 121.853 1.702 . . . . 0.5 112.227 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 42' ' ' MET . 47.3 mtpt -73.17 -51.08 19.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.942 -0.572 . . . . 2.78 111.174 -179.205 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 28.0 m -67.96 -27.07 36.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 120.998 -0.281 . . . . 0.39 110.931 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.32 -51.44 60.61 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.934 0.397 . . . . 0.32 110.527 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -70.06 -34.94 73.84 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.382 -0.372 . . . . 1.4 110.12 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.429 ' HB2' ' O ' ' A' ' 38' ' ' LYS . 14.4 ttm -61.96 -42.22 98.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.972 -0.558 . . . . 1.51 109.655 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 53.4 t90 -63.35 -49.95 71.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.228 -0.896 . . . . 0.41 110.191 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.512 ' HE2' HD12 ' A' ' 48' ' ' LEU . 11.9 tmtt? -58.16 -46.51 85.58 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.764 -0.653 . . . . 1.11 110.949 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.506 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 64.7 mm-40 -61.54 -47.35 85.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.029 -0.532 . . . . 1.96 111.7 -179.506 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -65.39 -45.7 82.95 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.177 -0.465 . . . . 1.58 111.152 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 72.9 mmm -63.4 -28.39 69.95 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.196 0.443 . . . . 0.7 112.196 -178.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.512 HD12 ' HE2' ' A' ' 44' ' ' LYS . 15.4 mt -97.26 14.99 24.1 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 111.927 0.343 . . . . 0.88 111.927 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.506 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 79.5 mtt180 -89.29 139.76 28.56 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 110.301 -0.259 . . . . 2.69 110.301 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.08 -18.32 27.49 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.942 2.428 . . . . 0.94 112.685 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.23 -7.15 56.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.211 0.529 . . . . 1.33 111.252 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.2 t -97.81 125.27 51.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.034 -0.53 . . . . 0.59 110.853 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -74.49 152.71 39.36 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.695 -0.684 . . . . 1.8 110.015 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -34.64 64.07 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.12 0.415 . . . . 0.81 112.12 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.59 -34.47 78.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.845 0.355 . . . . 3.58 110.671 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.4 mmt-85 -74.4 -33.47 63.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.381 -0.372 . . . . 3.05 110.299 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 57.4 mttt -65.44 -32.28 73.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.08 -0.509 . . . . 0.59 109.956 179.483 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 75.3 mt -63.94 -43.13 96.8 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.397 -0.594 . . . . 1.26 109.397 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.5 mp -64.78 -41.53 95.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.395 -0.82 . . . . 1.54 110.068 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.31 -36.6 93.41 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.884 -0.674 . . . . 0.37 111.458 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 49.1 tp -69.79 -36.14 75.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.998 0.428 . . . . 1.23 110.065 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 9.8 m-30 -61.59 -40.11 93.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.706 -0.679 . . . . 1.38 110.648 179.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.75 -40.78 98.32 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.917 -0.583 . . . . 1.45 110.539 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.485 ' O ' HG22 ' A' ' 68' ' ' VAL . 13.4 tmm? -61.5 -51.39 68.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.357 -0.383 . . . . 0.61 110.441 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.444 ' O ' ' HB2' ' A' ' 69' ' ' GLN . 13.5 t30 -58.92 -35.91 73.85 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.968 0.413 . . . . 1.69 111.086 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.469 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 1.9 t-80 -74.84 -50.42 17.14 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.302 -0.408 . . . . 1.54 111.804 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 9.9 p -60.18 -39.28 80.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 112.092 0.404 . . . . 1.4 112.092 -178.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.485 HG22 ' O ' ' A' ' 64' ' ' MET . 33.6 m -75.01 -24.18 17.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 120.769 -0.372 . . . . 0.43 111.03 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.444 ' HB2' ' O ' ' A' ' 65' ' ' ASN . 3.0 tp-100 -67.91 -49.53 61.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.111 0.481 . . . . 2.02 110.151 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 6.7 pt20 -82.89 -14.95 53.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.793 -0.64 . . . . 2.1 111.202 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.64 -38.67 91.79 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 120.994 0.426 . . . . 0.51 110.191 179.085 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -68.76 -25.65 64.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.66 -0.7 . . . . 2.09 110.383 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.19 -31.06 79.44 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 111.067 -0.813 . . . . 0.66 111.067 178.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -99.02 -3.19 35.42 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.205 -0.665 . . . . 1.62 109.205 178.426 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.0 mttp 57.84 40.09 26.32 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 114.696 -1.138 . . . . 2.7 112.05 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 24.3 mm -90.99 90.8 3.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.585 -0.524 . . . . 0.63 109.585 179.295 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 18.5 pt -66.85 -14.19 17.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.863 -0.608 . . . . 0.86 111.689 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -58.48 -44.16 89.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.876 0.369 . . . . 2.22 110.254 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -70.96 -37.33 72.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.129 -0.487 . . . . 1.34 110.444 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -62.12 -37.42 85.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.911 -0.586 . . . . 1.3 110.851 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -80.26 -46.81 15.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.535 -0.302 . . . . 1.32 110.677 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' SER . . . . . 0.557 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 66.1 m -57.65 -52.1 66.82 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.057 -0.52 . . . . 0.94 111.786 -179.525 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -82.44 -21.01 35.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.547 -0.297 . . . . 1.23 111.485 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -64.4 -51.3 53.67 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.861 -0.685 . . . . 0.34 113.491 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.557 ' HE2' ' HA ' ' A' ' 82' ' ' SER . 25.9 pttt -68.15 -12.77 61.49 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.776 0.658 . . . . 1.31 112.776 -178.343 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 33.1 m -109.35 -16.03 9.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 120.719 -0.392 . . . . 0.38 111.417 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.14 87.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.358 -0.383 . . . . 0.38 111.1 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.86 -38.82 83.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.056 -0.52 . . . . 0.45 110.95 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -63.84 -52.91 57.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.745 -0.662 . . . . 1.56 110.614 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.53 ' O ' HG12 ' A' ' 94' ' ' ILE . 99.6 t -65.38 -45.2 93.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.822 -0.627 . . . . 0.34 111.265 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -58.49 -45.09 89.43 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.732 0.301 . . . . 1.45 111.268 -179.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -68.17 -26.06 74.27 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.729 -0.748 . . . . 0.41 112.505 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 4.8 mmm-85 -85.54 -46.97 10.33 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.862 0.319 . . . . 3.46 111.862 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 90' ' ' VAL . 43.1 pt -65.84 -26.86 39.67 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 C-N-CA 121.119 -0.232 . . . . 0.5 111.371 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 60.7 t30 -62.27 -26.74 68.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.062 0.458 . . . . 1.0 110.493 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -81.67 -35.59 29.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.065 -0.516 . . . . 1.14 110.422 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -81.34 -30.04 33.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.834 -0.621 . . . . 1.33 111.396 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.411 ' HA ' ' HD3' ' A' ' 99' ' ' PRO . 8.2 m-30 -81.37 118.54 72.7 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 116.043 -0.526 . . . . 1.39 111.613 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 98' ' ' PHE . 25.8 Cg_exo -64.35 -177.41 0.5 Allowed 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.91 2.406 . . . . 1.47 111.582 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 67.7 mtm-85 -51.08 -49.48 60.56 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.114 0.483 . . . . 4.87 111.422 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.51 -39.23 79.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.42 -0.809 . . . . 2.58 112.899 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 32.4 mt -86.91 -34.0 19.53 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.098 0.777 . . . . 0.85 113.098 -177.346 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' LYS . . . . . 0.549 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 0.4 OUTLIER -68.2 -20.97 64.88 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.681 -0.408 . . . . 2.36 111.115 -179.407 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -70.15 -21.69 63.05 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.064 0.459 . . . . 2.57 109.906 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 42.7 mttm -77.91 -45.94 22.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.659 -0.701 . . . . 2.44 110.653 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 103' ' ' LYS . 4.0 pp -65.11 -24.69 67.5 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 110.148 -0.316 . . . . 1.27 110.148 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 60.3 m -60.95 -37.75 83.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.111 0.481 . . . . 1.15 110.152 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 28.0 ttm180 -72.95 -37.29 67.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.88 -0.6 . . . . 3.6 109.724 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 60.3 t -62.85 -49.43 83.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.711 -0.677 . . . . 1.25 110.411 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.549 HG21 HD11 ' A' ' 131' ' ' LEU . 93.3 t -59.48 -36.61 65.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.746 -0.661 . . . . 1.11 110.595 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -59.91 -54.28 48.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.165 -0.471 . . . . 1.74 110.467 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 55.8 mt -62.09 -40.14 86.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.94 -0.573 . . . . 1.21 110.879 -179.385 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.47 ' HA ' ' CG1' ' A' ' 118' ' ' ILE . 5.6 mp -63.82 -34.71 78.52 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.885 -0.598 . . . . 1.33 112.323 -179.244 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.6 ptmm? -90.27 -37.94 13.75 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.417 0.525 . . . . 1.69 112.417 -178.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -72.94 -36.03 67.11 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.347 0.499 . . . . 2.2 112.347 -178.504 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -95.05 5.62 51.37 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.947 -0.301 . . . . 3.23 111.298 -178.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 51.51 71.23 0.46 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.445 0.64 . . . . 2.0 110.629 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.47 ' CG1' ' HA ' ' A' ' 113' ' ' LEU . 30.3 mm -83.94 -42.8 17.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.77 -0.65 . . . . 0.61 110.288 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -115.07 177.94 4.47 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.075 -0.511 . . . . 1.26 110.051 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.2 t -68.7 159.89 31.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.375 -0.375 . . . . 1.3 110.464 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 45.4 mtmt -56.46 -41.53 76.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.872 -0.604 . . . . 2.85 111.573 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -61.89 -37.61 85.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.012 -0.54 . . . . 2.95 110.497 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.459 ' O ' HG13 ' A' ' 127' ' ' ILE . 68.1 t -70.95 -46.15 69.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.961 -0.563 . . . . 1.28 110.462 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.415 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 88.0 t -56.35 -46.78 81.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.153 -0.476 . . . . 1.23 110.62 179.754 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -63.03 -36.29 83.08 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.816 -0.629 . . . . 1.74 110.844 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -67.9 -40.06 83.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 1.44 110.305 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 123' ' ' VAL . 85.3 mt -63.72 -47.08 92.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.187 -0.46 . . . . 0.47 110.272 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 124' ' ' VAL . 43.8 mt-10 -58.23 -50.87 72.04 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.867 -0.606 . . . . 2.05 111.286 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 12.0 ptm180 -64.81 -26.03 68.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.432 -0.349 . . . . 3.98 111.599 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 74.0 m -68.47 -37.42 80.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.074 0.464 . . . . 0.7 110.343 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.549 HD11 HG21 ' A' ' 110' ' ' VAL . 29.5 mt -76.43 -41.87 46.07 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.856 -0.611 . . . . 1.33 110.595 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.03 99.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.853 -0.612 . . . . 0.69 111.8 -179.521 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.47 -30.44 71.56 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.256 -0.429 . . . . 0.84 111.427 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 1.12 110.887 -179.993 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 120.862 0.363 . . . . 5.47 110.596 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -93.52 119.87 33.1 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.708 -0.478 . . . . 5.34 109.708 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.471 ' HB2' ' HB3' ' A' ' 7' ' ' GLN . 16.1 m -73.25 126.31 29.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.259 -0.428 . . . . 2.73 110.773 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 m -67.01 133.12 49.29 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.177 -0.465 . . . . 3.24 111.069 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.8 mp0 54.76 34.57 22.1 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.903 -0.59 . . . . 2.9 111.592 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.471 ' HB3' ' HB2' ' A' ' 4' ' ' SER . 14.0 pt20 -58.82 -34.94 72.1 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.849 0.314 . . . . 2.75 111.849 -179.304 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -82.87 -43.49 16.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.132 0.492 . . . . 0.91 110.083 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.77 -40.27 87.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.499 -0.773 . . . . 0.86 112.396 -179.244 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 19.4 m -65.13 -37.72 88.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.692 0.282 . . . . 1.42 111.632 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.506 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 16.8 mmmt -69.36 -33.88 73.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.698 -0.228 . . . . 1.3 111.124 -179.286 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.3 mt -66.58 -23.86 66.26 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.947 0.404 . . . . 1.57 111.277 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -98.05 2.98 49.34 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.235 -0.439 . . . . 1.59 111.841 -179.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.4 p -120.37 15.39 12.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.026 0.441 . . . . 1.63 111.059 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 69.7 mt -97.05 165.73 11.93 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.371 0.605 . . . . 1.1 111.674 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.447 ' HG2' ' N ' ' A' ' 17' ' ' ASP . 35.3 tt0 -134.09 166.94 21.57 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.198 -1.038 . . . . 2.16 108.198 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.447 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 6.0 p-10 -72.77 5.83 2.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.815 0.34 . . . . 1.94 111.293 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.9 t -84.26 139.67 32.18 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.474 -0.33 . . . . 1.61 110.422 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -62.0 -33.02 73.56 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.166 -0.47 . . . . 2.64 110.306 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.02 -28.45 69.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.791 -0.641 . . . . 2.99 110.165 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 t -81.26 -53.47 6.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.924 -0.58 . . . . 1.1 110.606 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.0 mm -56.66 -43.34 78.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.389 -0.368 . . . . 0.88 110.86 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.6 t -60.88 -35.19 75.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 1.18 111.113 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.6 m -64.05 -32.98 74.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.267 -0.424 . . . . 1.16 111.934 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.421 ' HB2' HD21 ' A' ' 15' ' ' LEU . . . -90.84 -35.73 14.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.87 0.367 . . . . 0.45 110.869 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 22.4 t -62.74 -49.34 75.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.114 -0.493 . . . . 1.32 110.664 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.41 -22.6 67.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 2.38 110.638 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.481 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 62.1 t90 -78.91 -32.36 45.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.924 -0.58 . . . . 0.98 109.865 179.113 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.692 HD11 HG11 ' A' ' 39' ' ' VAL . 11.5 tp -81.88 -36.83 27.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.917 -0.583 . . . . 1.3 110.883 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 79.2 mt -61.47 -22.55 65.17 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.609 0.596 . . . . 1.06 112.609 -179.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 4.3 pp -85.79 -9.37 57.17 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.646 -0.422 . . . . 1.71 111.187 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -123.21 56.45 1.18 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.605 0.717 . . . . 1.51 110.563 -179.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 27.0 p90 -64.01 -7.12 7.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.597 -0.729 . . . . 1.61 112.371 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -65.04 -34.26 78.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.027 0.441 . . . . 3.97 110.662 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -96.74 23.7 6.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.757 -0.656 . . . . 1.7 111.501 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -52.37 -54.51 41.21 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 112.601 0.593 . . . . 0.43 112.601 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.34 -29.11 46.4 Favored 'Trans proline' 0 C--N 1.355 0.89 0 C-N-CA 121.563 1.509 . . . . 0.5 112.34 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -72.71 -46.14 55.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.931 -0.577 . . . . 2.78 111.226 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.692 HG11 HD11 ' A' ' 29' ' ' LEU . 35.8 m -71.74 -26.19 25.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.781 -0.368 . . . . 0.39 110.6 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.94 -47.8 67.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.111 -0.495 . . . . 0.32 111.194 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -69.85 -36.23 75.37 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.825 -0.35 . . . . 1.4 110.448 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.2 mtm -63.89 -42.64 97.41 Favored 'General case' 0 CA--C 1.522 -0.129 0 N-CA-C 109.754 -0.462 . . . . 1.51 109.754 178.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 73.9 t90 -61.09 -47.09 87.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.575 -0.739 . . . . 0.41 109.463 178.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.464 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 37.3 ttpt -59.23 -51.46 69.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.362 -0.835 . . . . 1.11 110.606 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -58.78 -43.71 90.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.013 -0.539 . . . . 1.96 111.589 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -60.41 -47.32 86.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.313 -0.403 . . . . 1.58 111.37 -179.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 55.5 mtp -72.0 -11.76 60.92 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.77 0.285 . . . . 0.7 111.77 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 67.3 mt -95.17 -8.61 35.82 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.755 0.312 . . . . 0.88 110.65 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -79.89 130.02 68.5 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.331 -0.395 . . . . 2.69 110.472 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.15 -8.95 24.86 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.937 2.425 . . . . 0.94 112.436 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.43 -17.88 50.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.293 0.568 . . . . 1.33 110.133 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 76.9 t -89.3 111.06 22.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 CA-C-N 115.394 -0.821 . . . . 0.59 110.41 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -69.17 163.1 25.64 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.915 -0.584 . . . . 1.8 110.898 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.4 -34.98 59.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 0.81 111.878 -179.374 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 40.2 mmm-85 -58.45 -48.13 81.75 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.173 0.511 . . . . 3.58 110.49 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 36.7 mmt-85 -71.58 -35.73 70.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.789 -0.641 . . . . 3.05 110.761 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.3 mttt -61.72 -48.32 81.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.818 0.342 . . . . 0.59 110.372 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 24.2 tp -63.74 -37.03 85.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.149 -0.478 . . . . 1.26 110.409 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -64.44 -45.18 88.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.983 -0.553 . . . . 1.54 110.568 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.5 -31.01 77.48 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.912 -0.661 . . . . 0.37 112.015 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 43.4 tp -64.47 -36.95 85.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.959 0.409 . . . . 1.23 110.51 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -63.4 -40.17 96.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.016 -0.538 . . . . 1.38 110.85 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 27.0 tp -62.99 -36.51 83.79 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.182 -0.463 . . . . 1.45 111.029 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.448 ' O ' HG22 ' A' ' 68' ' ' VAL . 14.3 tmm? -65.84 -46.6 77.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.271 -0.422 . . . . 0.61 110.296 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -59.34 -39.1 82.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.075 -0.512 . . . . 1.69 110.772 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -63.44 -56.83 13.07 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.625 -0.716 . . . . 1.54 111.849 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 27.8 m -62.71 -38.98 83.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 113.28 0.844 . . . . 1.4 113.28 -177.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.448 HG22 ' O ' ' A' ' 64' ' ' MET . 32.6 m -73.91 -28.43 24.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 120.447 -0.501 . . . . 0.43 111.718 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -78.51 -45.56 21.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.776 0.322 . . . . 2.02 110.468 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -71.58 -17.94 62.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.311 -0.404 . . . . 2.1 110.875 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.49 -22.98 67.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.204 -0.453 . . . . 0.51 111.097 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.4 mmtt -63.19 -36.59 84.14 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.279 -0.418 . . . . 2.09 110.589 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -80.23 -28.81 47.74 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.741 -0.743 . . . . 0.66 111.886 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -80.1 -22.26 42.37 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.795 0.331 . . . . 1.62 110.279 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm 65.73 29.3 10.76 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.449 -0.796 . . . . 2.7 111.111 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 33.1 mm -104.15 92.87 2.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.514 -0.767 . . . . 0.63 109.508 179.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 17.3 pt -70.3 -14.57 18.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.935 -0.575 . . . . 0.86 111.304 -179.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 17.6 mp0 -55.69 -39.06 70.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.37 -0.377 . . . . 2.22 110.81 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -69.23 -50.68 45.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.117 -0.492 . . . . 1.34 110.766 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -63.89 -34.61 78.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.729 -0.669 . . . . 1.3 111.44 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.479 ' O ' ' HG2' ' A' ' 85' ' ' LYS . 6.7 t70 -67.54 -50.79 56.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.973 0.416 . . . . 1.32 110.456 179.292 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.7 m -66.05 -44.64 83.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.795 -0.639 . . . . 0.94 111.981 -179.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -75.49 -27.18 58.7 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 121.04 -0.264 . . . . 1.23 111.534 -179.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.71 -44.51 89.34 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.807 -0.711 . . . . 0.34 113.261 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' A' ' 81' ' ' ASP . 2.3 ptpp? -65.96 -27.4 68.12 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.05 0.389 . . . . 1.31 112.05 -179.061 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 35.3 m -93.8 -21.8 5.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 120.742 -0.383 . . . . 0.38 111.075 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' ' 91' ' ' LEU . . . -62.84 -43.07 99.77 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.275 -0.42 . . . . 0.38 110.98 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.58 -35.42 70.37 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.117 0.484 . . . . 0.45 110.998 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.648 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 6.1 tp10 -76.28 -56.29 4.78 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.97 -0.559 . . . . 1.56 110.279 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 70.5 t -56.91 -46.75 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.236 -0.438 . . . . 0.34 112.052 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.447 ' HB2' ' O ' ' A' ' 87' ' ' ALA . 2.4 mm? -60.23 -39.76 87.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.685 0.278 . . . . 1.45 110.587 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -67.93 -27.88 73.56 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.666 -0.778 . . . . 0.41 112.248 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.648 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 11.8 mmt85 -80.48 -50.9 9.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.666 0.27 . . . . 3.46 111.014 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.418 ' HA ' ' HG2' ' A' ' 97' ' ' GLU . 41.8 pt -64.56 -31.88 55.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 111.808 0.299 . . . . 0.5 111.808 -178.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -68.8 -17.37 64.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.701 0.286 . . . . 1.0 111.385 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 11.5 pt20 -106.93 8.12 30.37 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 122.014 -0.429 . . . . 1.14 111.776 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 6.2 pt-20 -129.79 -30.5 2.04 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.711 0.291 . . . . 1.33 111.096 178.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -71.47 139.52 84.08 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.382 -0.372 . . . . 1.39 111.055 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.456 ' HD2' HD12 ' A' ' 102' ' ' LEU . 37.0 Cg_endo -66.9 177.09 3.79 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.92 2.413 . . . . 1.47 112.337 178.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.522 ' O ' ' HG2' ' A' ' 103' ' ' LYS . 17.1 mmm-85 -57.33 -44.3 84.13 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.476 0.547 . . . . 4.87 112.476 -178.408 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.23 -32.62 74.15 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.673 0.249 . . . . 2.58 111.673 -178.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.456 HD12 ' HD2' ' A' ' 99' ' ' PRO . 15.6 mt -83.46 -35.54 24.87 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.823 -0.351 . . . . 0.85 111.497 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 100' ' ' ARG . 10.9 ptmm? -63.02 -33.17 74.86 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.915 0.388 . . . . 2.36 109.972 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 47.2 mttt -67.65 -39.6 84.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.058 -0.519 . . . . 2.57 110.645 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.499 ' O ' HG23 ' A' ' 109' ' ' VAL . 81.9 mttt -66.14 -42.77 88.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.786 -0.643 . . . . 2.44 110.679 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 103' ' ' LYS . 3.7 pp -72.51 -23.03 60.96 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.626 -0.429 . . . . 1.27 110.588 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 61.7 m -61.91 -45.08 95.26 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 116.53 -0.305 . . . . 1.15 110.537 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -73.52 -27.98 61.65 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.805 -0.358 . . . . 3.6 110.493 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.55 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 94.5 t -68.52 -47.22 78.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.335 -0.393 . . . . 1.25 110.209 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.422 ' HA ' HD12 ' A' ' 113' ' ' LEU . 9.3 p -75.69 -24.8 17.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 1.11 110.746 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -65.26 -48.4 73.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.283 -0.417 . . . . 1.74 110.479 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.444 HG22 ' O ' ' A' ' 109' ' ' VAL . 11.4 tt -63.61 -26.19 40.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.376 -0.375 . . . . 1.21 110.867 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 87.5 mt -67.59 -41.99 83.21 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.765 0.317 . . . . 1.33 111.003 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -84.49 -26.52 28.08 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.807 -0.357 . . . . 1.69 111.0 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -71.49 -35.36 70.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.833 0.349 . . . . 2.2 110.818 179.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 31.5 mmm180 -94.13 3.37 55.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.252 -0.431 . . . . 3.23 111.001 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 52.09 56.83 7.2 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.454 0.645 . . . . 2.0 110.433 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 44.5 mm -72.47 -46.45 55.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.457 -0.792 . . . . 0.61 111.116 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -105.55 170.46 7.88 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.265 -0.425 . . . . 1.26 110.994 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.16 147.09 53.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.958 -0.565 . . . . 1.3 110.302 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -57.24 -29.2 63.59 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.931 0.396 . . . . 2.85 111.343 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -59.56 -47.66 84.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.969 -0.559 . . . . 2.95 111.578 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.528 ' O ' HG13 ' A' ' 127' ' ' ILE . 10.8 p -84.86 -31.27 7.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.295 -0.411 . . . . 1.28 111.274 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 39.0 t -59.34 -43.1 89.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 120.913 0.387 . . . . 1.23 110.381 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -67.69 -20.25 65.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.804 -0.635 . . . . 1.74 111.045 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -83.35 -36.12 24.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.985 0.421 . . . . 1.44 110.266 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.528 HG13 ' O ' ' A' ' 123' ' ' VAL . 42.2 mt -68.04 -51.32 50.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.156 -0.474 . . . . 0.47 110.875 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.58 -38.41 84.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.37 -0.377 . . . . 2.05 111.84 -179.031 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 15.3 ptp180 -71.21 -33.85 70.3 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.738 -0.385 . . . . 3.98 110.65 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 67.8 m -65.16 -38.59 91.06 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.03 0.443 . . . . 0.7 110.225 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 127' ' ' ILE . 58.2 mt -65.74 -40.2 91.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.846 -0.616 . . . . 1.33 109.947 179.369 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.7 -33.85 66.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.784 -0.643 . . . . 0.69 111.103 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.47 -37.54 86.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.928 0.394 . . . . 0.84 111.126 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -71.2 -16.9 62.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.05 -0.523 . . . . 1.12 110.888 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 131' ' ' LEU . 76.2 mt -92.1 -1.08 57.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.219 -0.446 . . . . 4.04 110.554 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -82.43 4.83 22.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.06 -0.518 . . . . 6.64 110.721 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 35.9 m-70 . . . . . 0 C--O 1.246 0.891 0 CA-C-N 115.645 -0.707 . . . . 8.0 111.09 179.092 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 206' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo . . . . . 0 N--CA 1.484 0.915 0 N-CA-C 112.628 0.203 . . . . 7.47 112.628 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 41.1 m 72.61 123.75 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.776 0.798 . . . . 6.02 112.497 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 208' ' ' TYR . . . . . 0.552 ' CE2' ' HA ' ' B' ' 213' ' ' PRO . 44.2 t80 -110.49 128.3 55.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.571 -0.74 . . . . 4.07 110.897 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 209' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -50.4 -33.48 37.73 Favored 'Trans proline' 0 N--CA 1.477 0.523 0 C-N-CA 123.302 2.668 . . . . 4.35 114.37 -179.275 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 1.3 m -77.47 -15.12 59.49 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.803 0.335 . . . . 4.95 111.425 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 18.5 m -129.39 78.67 75.39 Favored Pre-proline 0 C--O 1.236 0.361 0 CA-C-O 121.072 0.463 . . . . 3.16 110.054 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 213' ' ' PRO . . . . . 0.552 ' HA ' ' CE2' ' B' ' 208' ' ' TYR . 1.9 Cg_endo -86.22 -34.6 0.15 Allowed 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 123.327 2.685 . . . . 4.03 113.582 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 3.6 m . . . . . 0 C--O 1.246 0.907 0 CA-C-O 118.407 -0.806 . . . . 5.57 110.371 -179.245 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.125 0 CA-C-O 120.777 0.322 . . . . 5.47 110.846 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -138.2 122.27 17.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.382 -0.372 . . . . 5.34 110.15 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.82 117.47 34.21 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.195 -0.457 . . . . 2.73 110.814 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.2 m -72.57 138.07 46.61 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.297 -0.411 . . . . 3.24 111.105 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 56.97 30.43 18.08 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.622 -0.717 . . . . 2.9 111.538 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -62.42 -31.19 71.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.036 0.446 . . . . 2.75 111.108 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -87.22 -40.36 14.62 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.102 -0.499 . . . . 0.91 110.059 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.39 -38.85 92.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.738 -0.665 . . . . 0.86 111.623 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.83 -29.78 69.79 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.327 -0.397 . . . . 1.42 110.83 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.485 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 62.4 mmtt -71.8 -42.91 66.5 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 120.973 0.416 . . . . 1.3 110.625 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.92 -23.53 67.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.832 -0.622 . . . . 1.57 111.395 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -95.21 5.04 52.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.163 -0.471 . . . . 1.59 112.028 -178.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 p -130.61 20.47 5.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 1.63 111.253 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 52.0 mt -102.87 133.17 48.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.865 0.364 . . . . 1.1 111.577 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -100.32 173.69 6.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.601 -0.727 . . . . 2.16 109.359 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -80.83 35.57 0.37 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.408 0.623 . . . . 1.94 110.896 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.483 ' HB3' ' OG ' ' A' ' 21' ' ' SER . 4.0 t -107.26 136.95 46.2 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.102 -0.499 . . . . 1.61 109.735 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.475 ' OE1' ' HA ' ' B' ' 208' ' ' TYR . 0.0 OUTLIER -57.87 -44.0 86.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.935 -0.575 . . . . 2.64 111.289 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -62.97 -39.47 94.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.688 0.28 . . . . 2.99 111.432 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.483 ' OG ' ' HB3' ' A' ' 18' ' ' SER . 4.7 m -62.43 -50.56 71.01 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.356 -0.384 . . . . 1.1 110.387 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.9 mm -63.42 -38.43 82.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.261 -0.427 . . . . 0.88 109.983 179.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 47.0 t -60.31 -39.34 86.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.936 -0.574 . . . . 1.18 110.539 179.35 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.4 m -61.09 -45.42 94.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 1.16 110.752 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.12 -34.29 66.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.397 -0.365 . . . . 0.45 110.827 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 44.0 t -62.7 -50.75 69.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.972 -0.558 . . . . 1.32 110.373 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -59.12 -37.12 76.46 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.133 0.492 . . . . 2.38 110.495 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.453 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 9.3 t90 -66.39 -39.13 88.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.379 -0.828 . . . . 0.98 110.724 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.7 tp -76.05 -35.51 59.41 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.406 -0.361 . . . . 1.3 111.015 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 78.4 mt -60.18 -32.02 70.68 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.179 -0.464 . . . . 1.06 112.248 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 2.8 pp -78.62 -26.66 45.33 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.793 -0.363 . . . . 1.71 111.21 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -98.1 48.74 1.0 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.627 0.727 . . . . 1.51 110.669 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.6 p90 -70.9 -4.22 23.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.462 -0.79 . . . . 1.61 111.467 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -70.54 -30.09 66.73 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.168 -0.679 . . . . 3.97 109.168 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -107.94 31.87 5.18 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.202 -0.908 . . . . 1.7 110.091 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.456 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -51.57 -51.6 68.12 Favored Pre-proline 0 CA--C 1.537 0.452 0 CA-C-N 115.653 -0.703 . . . . 0.43 112.097 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 32.8 Cg_endo -64.42 -31.63 61.55 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 121.582 1.521 . . . . 0.5 111.822 179.212 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 42' ' ' MET . 0.6 OUTLIER -67.5 -47.74 69.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.866 -0.606 . . . . 2.78 111.247 -179.255 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.2 m -71.97 -27.51 27.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 C-N-CA 120.705 -0.398 . . . . 0.39 110.322 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.13 -47.27 62.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.166 -0.47 . . . . 0.32 110.426 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -68.66 -35.91 77.87 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.226 -0.443 . . . . 1.4 109.992 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.413 ' HB2' ' O ' ' A' ' 38' ' ' LYS . 14.7 ttm -64.26 -42.85 96.28 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.06 -0.518 . . . . 1.51 110.119 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 61.9 t90 -60.14 -52.08 66.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.446 -0.797 . . . . 0.41 110.674 179.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.0 ttpt -61.03 -50.22 74.23 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.633 -0.712 . . . . 1.11 111.629 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -61.46 -33.66 74.12 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.307 -0.406 . . . . 1.96 112.045 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -73.9 -44.51 55.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.628 0.251 . . . . 1.58 111.004 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 62.6 mtp -70.48 -13.46 62.13 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.002 0.371 . . . . 0.7 112.002 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 49.9 mt -92.93 2.15 56.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.943 0.401 . . . . 0.88 110.609 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 59.2 mtp180 -88.0 136.5 32.21 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.105 -0.498 . . . . 2.69 110.443 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -68.98 -12.61 34.78 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.793 2.328 . . . . 0.94 112.337 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.44 -6.35 56.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.791 -0.641 . . . . 1.33 111.191 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 42.3 t -100.38 118.53 47.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.94 0.4 . . . . 0.59 110.798 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -74.68 158.45 33.57 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.799 -0.637 . . . . 1.8 110.223 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -33.23 62.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.403 -0.362 . . . . 0.81 111.781 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.0 mmm-85 -59.48 -44.74 92.98 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.142 -0.481 . . . . 3.58 110.939 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.403 ' HD3' ' HA ' ' A' ' 56' ' ' ARG . 12.4 mmt180 -75.84 -30.35 58.92 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.436 -0.347 . . . . 3.05 110.88 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -64.16 -41.98 96.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.03 0.443 . . . . 0.59 109.888 179.029 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 25.6 tp -66.41 -40.57 89.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.832 -0.622 . . . . 1.26 110.216 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -64.53 -41.83 96.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.051 -0.522 . . . . 1.54 110.388 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.19 -36.68 93.17 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.791 -0.719 . . . . 0.37 111.619 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 30.6 tp -63.8 -35.9 82.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.937 0.399 . . . . 1.23 110.122 178.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -65.09 -41.21 95.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.862 -0.608 . . . . 1.38 110.773 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 23.9 tp -64.94 -42.47 94.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.262 -0.426 . . . . 1.45 110.495 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 14.1 tmm? -61.52 -45.64 93.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.033 -0.53 . . . . 0.61 110.154 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -61.36 -36.32 79.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.83 -0.623 . . . . 1.69 111.089 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.564 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 4.3 t-80 -67.05 -56.88 8.16 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.744 -0.662 . . . . 1.54 111.456 -179.442 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 35.0 m -59.74 -39.29 79.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.218 0.821 . . . . 1.4 113.218 -177.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 34.7 m -71.12 -27.31 29.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 120.466 -0.494 . . . . 0.43 112.049 -178.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 62.7 mt-30 -73.68 -46.44 46.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.942 0.401 . . . . 2.02 110.131 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.564 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 37.5 mm-40 -74.58 -21.33 59.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.863 -0.608 . . . . 2.1 110.934 -179.185 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.58 -35.01 71.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.304 -0.407 . . . . 0.51 111.1 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -74.68 -20.81 59.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.86 0.362 . . . . 2.09 110.634 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -73.77 -32.54 59.05 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.698 -0.763 . . . . 0.66 111.241 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -97.69 -0.76 44.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.186 0.517 . . . . 1.62 109.87 179.034 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.8 mmmm 63.19 40.68 8.63 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.12 -0.945 . . . . 2.7 111.252 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.3 mm -100.25 86.28 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.091 -0.504 . . . . 0.63 109.783 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 25.2 pt -68.78 -18.6 23.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.847 -0.615 . . . . 0.86 111.489 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -59.47 -41.49 89.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.09 -0.505 . . . . 2.22 110.834 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -66.68 -50.68 62.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.852 -0.613 . . . . 1.34 111.188 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -62.06 -34.47 76.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.674 -0.694 . . . . 1.3 111.885 -178.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.49 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 13.8 t70 -71.26 -53.68 13.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.706 0.288 . . . . 1.32 110.359 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.9 m -59.28 -44.09 92.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.882 -0.599 . . . . 0.94 112.04 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -77.29 -35.82 54.76 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.771 0.285 . . . . 1.23 111.771 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.85 -41.21 97.59 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 121.178 -0.534 . . . . 0.34 114.039 -178.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.49 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 12.7 ptpt -65.71 -31.12 71.94 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.324 0.49 . . . . 1.31 112.324 -178.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.3 m -95.83 -19.38 6.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.64 -0.424 . . . . 0.38 111.241 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.68 -42.14 99.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.394 -0.367 . . . . 0.38 111.242 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.29 -41.71 80.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.439 . . . . 0.45 110.985 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.622 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 6.3 tp10 -67.0 -54.04 25.57 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.902 -0.59 . . . . 1.56 110.493 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 96.0 t -59.3 -45.65 93.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 0.34 111.607 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -56.78 -44.16 81.58 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.538 -0.301 . . . . 1.45 111.293 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -66.97 -37.19 91.97 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.454 -0.879 . . . . 0.41 112.424 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.622 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 9.8 mmt180 -68.17 -48.4 65.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.696 0.284 . . . . 3.46 110.958 -179.652 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.493 ' HA ' ' HG2' ' A' ' 97' ' ' GLU . 45.2 pt -70.08 -23.88 25.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.079 0.466 . . . . 0.5 111.043 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.486 ' ND2' ' HB3' ' A' ' 134' ' ' ALA . 7.1 t30 -65.79 -24.67 66.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.975 -0.557 . . . . 1.0 110.832 179.788 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.522 ' HB3' ' HB1' ' A' ' 134' ' ' ALA . 9.6 pt20 -110.63 1.25 17.9 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.55 0.574 . . . . 1.14 112.55 -178.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.493 ' HG2' ' HA ' ' A' ' 94' ' ' ILE . 1.5 pt-20 -117.69 -20.05 9.08 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.864 -0.334 . . . . 1.33 111.665 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -80.87 145.77 58.18 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 120.799 0.333 . . . . 1.39 111.279 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -66.26 171.78 9.83 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 123.046 2.498 . . . . 1.47 112.164 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -56.99 -42.66 80.65 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.565 0.58 . . . . 4.87 112.565 -178.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.21 -46.79 76.02 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 121.133 -0.227 . . . . 2.58 111.299 -178.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.487 HD23 ' HD2' ' A' ' 105' ' ' LYS . 36.7 mt -71.81 -29.69 64.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.827 0.346 . . . . 0.85 110.67 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LYS . . . . . 0.428 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 0.0 OUTLIER -56.02 -50.89 69.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.773 -0.648 . . . . 2.36 110.574 179.53 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 57.1 tttt -66.04 -36.07 82.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.265 -0.425 . . . . 2.57 110.659 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.487 ' HD2' HD23 ' A' ' 102' ' ' LEU . 88.5 mttt -63.58 -44.06 95.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.148 -0.478 . . . . 2.44 110.913 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.473 ' O ' HG12 ' A' ' 109' ' ' VAL . 1.7 pp -74.54 -27.86 60.7 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.974 -0.291 . . . . 1.27 110.693 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 52.4 m -67.47 -41.05 85.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.515 -0.312 . . . . 1.15 111.242 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.462 ' O ' HG13 ' A' ' 112' ' ' ILE . 16.3 ptt180 -76.57 -31.75 57.74 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.848 -0.341 . . . . 3.6 110.708 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -69.02 -38.92 79.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-O 120.69 0.281 . . . . 1.25 110.637 -179.86 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 8.4 p -80.1 -21.13 11.83 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-O 121.257 0.551 . . . . 1.11 110.066 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -68.05 -41.6 81.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.743 -0.662 . . . . 1.74 109.625 179.397 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 108' ' ' ARG . 67.1 mt -62.64 -36.23 74.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.851 -0.613 . . . . 1.21 110.047 179.349 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 87.7 mt -61.84 -49.34 76.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 1.33 111.245 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -75.63 -28.04 58.65 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 121.008 -0.277 . . . . 1.69 111.59 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.448 ' HA ' ' OE1' ' A' ' 115' ' ' GLU . 2.6 mm-40 -73.71 -39.2 64.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.711 0.291 . . . . 2.2 111.064 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -83.79 -0.6 51.71 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.803 0.335 . . . . 3.23 110.367 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.89 48.42 8.92 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.435 -0.802 . . . . 2.0 110.808 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 42.9 mm -70.42 -46.14 72.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.75 -0.659 . . . . 0.61 109.979 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -101.84 164.71 11.58 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.811 -0.631 . . . . 1.26 110.19 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.6 t -68.77 145.82 53.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.211 -0.449 . . . . 1.3 110.162 179.275 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -59.03 -25.94 64.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.487 -0.324 . . . . 2.85 110.778 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -62.39 -38.56 90.08 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.074 -0.512 . . . . 2.95 111.09 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.473 ' O ' HG13 ' A' ' 127' ' ' ILE . 12.9 p -90.27 -31.48 5.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.841 -0.344 . . . . 1.28 110.504 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.405 ' O ' ' HG2' ' A' ' 128' ' ' GLU . 47.7 t -59.8 -38.33 75.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 120.984 0.421 . . . . 1.23 110.245 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -62.25 -26.53 68.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.809 -0.632 . . . . 1.74 110.77 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.528 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 38.7 t70 -87.28 -36.67 17.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.351 -0.386 . . . . 1.44 110.205 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.521 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 77.2 mt -60.89 -50.51 80.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.226 -0.443 . . . . 0.47 110.723 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 124' ' ' VAL . 4.6 pt-20 -63.73 -37.29 86.79 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.396 -0.365 . . . . 2.05 111.578 -179.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.528 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 6.5 ptp180 -70.34 -32.47 70.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.621 -0.263 . . . . 3.98 110.852 -179.203 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 49.0 m -65.89 -40.2 91.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.885 0.374 . . . . 0.7 110.394 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 127' ' ' ILE . 23.8 mt -66.26 -44.41 83.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.988 -0.551 . . . . 1.33 110.245 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.91 -36.63 78.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.886 -0.597 . . . . 0.69 111.715 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -59.25 -46.18 89.19 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.963 0.357 . . . . 0.84 111.963 -179.437 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.522 ' HB1' ' HB3' ' A' ' 96' ' ' GLN . . . -68.3 -18.73 64.59 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.855 0.359 . . . . 1.12 111.468 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 131' ' ' LEU . 97.4 mt -87.43 -6.9 58.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.393 -0.367 . . . . 4.04 110.573 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -76.43 -22.28 54.85 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.256 -0.429 . . . . 6.64 110.052 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 . . . . . 0 C--O 1.248 0.993 0 CA-C-N 115.422 -0.808 . . . . 8.0 110.507 -179.993 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 206' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo . . . . . 0 N--CA 1.482 0.816 0 N-CA-C 112.462 0.139 . . . . 7.47 112.462 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 2.2 m 59.33 80.52 0.19 Allowed 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.152 0.501 . . . . 6.02 112.021 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 208' ' ' TYR . . . . . 0.475 ' HA ' ' OE1' ' A' ' 19' ' ' GLN . 66.8 t80 -62.77 129.76 41.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.46 -0.336 . . . . 4.07 110.524 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 209' ' ' SEP . . . . . 0.426 ' HA ' ' HD3' ' B' ' 210' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 210' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' B' ' 209' ' ' SEP . 31.4 Cg_exo -60.59 -27.89 85.64 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.907 2.405 . . . . 4.35 112.73 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.93 -4.95 58.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.185 0.517 . . . . 4.95 110.696 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 19.2 m -137.95 77.53 37.53 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.028 -0.533 . . . . 3.16 110.092 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 213' ' ' PRO . . . . . 0.463 ' HB2' ' NE2' ' A' ' 66' ' ' HIS . 87.5 Cg_endo -89.13 -7.15 5.25 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.723 2.282 . . . . 4.03 113.445 -179.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 66.2 m . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.542 -0.742 . . . . 5.57 110.463 -179.649 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 120.813 0.34 . . . . 5.47 110.763 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -80.76 140.41 35.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.415 -0.357 . . . . 5.34 110.551 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.9 m -66.87 111.57 3.83 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.223 -0.444 . . . . 2.73 110.685 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.5 m -92.97 160.17 15.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.232 -0.44 . . . . 3.24 110.491 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 54.62 38.76 30.49 Favored 'General case' 0 N--CA 1.464 0.229 0 O-C-N 123.655 0.597 . . . . 2.9 111.845 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -64.6 -34.78 79.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.321 -0.4 . . . . 2.75 110.617 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -64.13 -47.38 80.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.945 -0.57 . . . . 0.91 110.285 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -39.14 93.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.06 -0.518 . . . . 0.86 110.881 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 12.2 m -63.36 -35.89 81.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.964 -0.562 . . . . 1.42 110.59 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.503 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 65.4 mmtt -65.04 -41.86 94.82 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.046 -0.524 . . . . 1.3 110.247 179.113 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -62.0 -34.49 76.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.853 -0.612 . . . . 1.57 111.235 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -77.98 -5.67 52.0 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.992 -0.549 . . . . 1.59 111.695 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 p -123.83 18.56 9.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.815 0.34 . . . . 1.63 111.604 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 17.0 mt -95.16 169.11 10.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.087 0.47 . . . . 1.1 111.39 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -139.79 -174.27 3.86 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.72 -0.673 . . . . 2.16 109.215 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -91.5 12.1 21.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.779 0.323 . . . . 1.94 111.424 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.478 ' O ' HG12 ' A' ' 22' ' ' ILE . 0.1 OUTLIER -85.41 132.25 34.25 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.867 -0.419 . . . . 1.61 109.867 179.093 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.512 ' OE1' ' HA ' ' B' ' 208' ' ' TYR . 0.0 OUTLIER -62.13 -29.37 70.29 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.69 0.281 . . . . 2.64 110.749 -179.455 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 -67.55 -44.09 79.1 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.811 -0.44 . . . . 2.99 109.811 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.1 m -64.63 -41.24 96.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.929 -0.578 . . . . 1.1 109.922 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 18' ' ' SER . 38.3 mm -63.41 -49.0 84.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 N-CA-C 109.257 -0.645 . . . . 0.88 109.257 178.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.8 m -57.28 -35.8 70.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.127 -0.488 . . . . 1.18 111.001 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.5 t -59.82 -40.07 87.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.456 . . . . 1.16 111.077 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.5 -43.65 13.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.319 -0.401 . . . . 0.45 111.206 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.405 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 37.9 m -59.36 -41.31 88.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.255 -0.43 . . . . 1.32 111.624 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.524 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 21.2 ttpt -61.95 -35.25 77.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.755 0.312 . . . . 2.38 110.194 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.526 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 25.0 t90 -72.81 -40.61 65.7 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.47 -0.567 . . . . 0.98 109.47 179.265 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -62.95 -38.46 91.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.831 -0.622 . . . . 1.3 110.756 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 26' ' ' SER . 86.4 mt -63.75 -28.26 69.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.985 0.421 . . . . 1.06 110.537 179.28 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 68.9 mt -76.09 -27.63 57.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.945 -0.571 . . . . 1.71 109.546 178.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' A' ' 28' ' ' TRP . 50.1 mm-40 -97.24 36.86 1.39 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.479 -0.782 . . . . 1.51 110.211 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.8 p90 -67.26 -1.58 4.74 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 121.057 0.456 . . . . 1.61 111.304 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -82.83 -8.8 59.55 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.02 -0.536 . . . . 3.97 109.86 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -131.39 37.75 3.67 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.687 -0.688 . . . . 1.7 110.343 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.439 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -57.36 -52.23 75.78 Favored Pre-proline 0 CA--C 1.537 0.481 0 CA-C-N 115.869 -0.605 . . . . 0.43 112.45 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.442 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 32.4 Cg_endo -64.74 -27.02 60.19 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 121.797 1.665 . . . . 0.5 112.362 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.6 -39.08 77.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.983 -0.553 . . . . 2.78 111.091 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 24.6 m -85.59 -22.58 7.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 120.61 -0.436 . . . . 0.39 110.669 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.36 -46.08 74.42 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.199 -0.455 . . . . 0.32 110.737 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 3.3 pt-20 -64.13 -40.75 96.84 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.257 -0.429 . . . . 1.4 110.052 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.422 ' N ' ' HG3' ' A' ' 41' ' ' GLU . 42.5 ttm -64.67 -41.07 96.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.596 -0.729 . . . . 1.51 110.521 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -62.18 -49.48 75.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.743 -0.662 . . . . 0.41 110.36 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.458 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 23.2 ttpp -57.82 -51.28 70.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.921 -0.581 . . . . 1.11 111.04 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.416 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 11.4 mm-40 -61.28 -38.65 87.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.144 -0.48 . . . . 1.96 111.168 -179.359 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.436 ' O ' HG21 ' A' ' 52' ' ' VAL . 79.1 t80 -62.03 -46.65 88.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.921 0.391 . . . . 1.58 110.67 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 76.9 mmm -67.05 -25.2 66.14 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.2 -0.454 . . . . 0.7 111.407 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 82.0 mt -93.94 12.7 25.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.396 -0.365 . . . . 0.88 111.299 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 11.9 mtp85 -96.66 133.56 24.39 Favored Pre-proline 0 C--N 1.327 -0.401 0 N-CA-C 110.333 -0.247 . . . . 2.69 110.333 179.349 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -70.28 -15.89 35.26 Favored 'Trans proline' 0 CA--C 1.53 0.284 0 C-N-CA 122.924 2.416 . . . . 0.94 113.307 -179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.69 10.47 7.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.032 0.444 . . . . 1.33 110.946 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.436 HG21 ' O ' ' A' ' 46' ' ' TYR . 41.2 t -110.39 122.0 64.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.949 -0.569 . . . . 0.59 110.514 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -69.01 156.45 38.6 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.96 -0.564 . . . . 1.8 110.93 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.12 -41.81 72.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.876 0.369 . . . . 0.81 111.73 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -68.89 -29.81 68.17 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.423 -0.353 . . . . 3.58 110.497 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.0 mmm-85 -70.96 -38.68 72.82 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.602 -0.518 . . . . 3.05 109.602 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -67.21 -34.82 78.3 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.377 -0.601 . . . . 0.59 109.377 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 20.1 tp -63.05 -37.97 89.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.581 -0.736 . . . . 1.26 109.927 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 mp -66.25 -40.59 90.3 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.688 -0.687 . . . . 1.54 110.007 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.66 -33.79 88.18 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.916 -0.659 . . . . 0.37 111.562 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.84 -44.13 86.41 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.391 -0.596 . . . . 1.23 109.391 178.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -61.78 -39.47 91.81 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.284 -0.871 . . . . 1.38 110.876 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 20.2 tp -63.6 -41.28 98.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.928 -0.578 . . . . 1.45 110.389 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.484 ' O ' HG22 ' A' ' 68' ' ' VAL . 16.9 tmm? -62.87 -51.57 66.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.886 -0.597 . . . . 0.61 110.699 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -56.11 -35.52 67.15 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.063 0.458 . . . . 1.69 110.923 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -68.67 -58.12 4.7 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.709 -0.678 . . . . 1.54 111.687 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 17.5 m -60.52 -39.86 82.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 113.052 0.76 . . . . 1.4 113.052 -177.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.484 HG22 ' O ' ' A' ' 64' ' ' MET . 30.7 m -72.96 -31.03 34.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 120.515 -0.474 . . . . 0.43 111.88 -178.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -77.7 -43.09 32.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.954 0.407 . . . . 2.02 110.473 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -71.52 -24.89 62.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.197 -0.456 . . . . 2.1 110.588 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.29 -18.72 65.52 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.297 -0.41 . . . . 0.51 110.566 179.123 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt -68.29 -29.21 67.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.27 -0.423 . . . . 2.09 109.879 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.2 -47.73 28.68 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.965 -0.636 . . . . 0.66 111.574 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -78.75 -7.68 58.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.919 0.39 . . . . 1.62 110.289 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.7 mttp 60.46 40.27 17.37 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.489 -0.778 . . . . 2.7 111.267 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 40.1 mm -93.25 94.79 4.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.766 -0.652 . . . . 0.63 109.813 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 10.9 pt -70.73 -22.47 23.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.083 -0.508 . . . . 0.86 111.224 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -56.23 -33.46 65.41 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.916 0.389 . . . . 2.22 110.702 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -71.51 -53.44 13.85 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.934 -0.576 . . . . 1.34 110.577 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -63.88 -31.54 72.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.82 -0.627 . . . . 1.3 111.799 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -71.23 -57.36 4.56 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.964 0.412 . . . . 1.32 111.426 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.9 m -65.36 -42.35 92.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.878 -0.601 . . . . 0.94 112.327 -178.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -78.32 -28.66 47.38 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.7 -0.4 . . . . 1.23 111.184 -179.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -68.23 -42.9 82.09 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.777 -0.725 . . . . 0.34 113.051 -179.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -65.3 -27.12 68.39 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.019 0.377 . . . . 1.31 112.019 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.6 m -97.26 -18.29 6.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-O 120.772 0.32 . . . . 0.38 111.316 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.23 -45.53 91.2 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.254 -0.43 . . . . 0.38 111.382 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -50.88 -46.69 60.56 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.386 0.429 . . . . 0.45 111.515 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.596 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 3.5 tp10 -62.43 -60.03 4.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.76 -0.654 . . . . 1.56 110.529 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.452 ' O ' HG12 ' A' ' 94' ' ' ILE . 80.0 t -54.97 -49.4 71.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.837 -0.619 . . . . 0.34 112.363 -178.615 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 82.0 mt -61.09 -38.0 84.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.611 0.243 . . . . 1.45 111.629 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -72.22 -31.06 64.2 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.544 -0.836 . . . . 0.41 112.0 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.596 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 47.8 mmm-85 -76.59 -50.35 14.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.514 0.197 . . . . 3.46 111.233 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.452 HG12 ' O ' ' A' ' 90' ' ' VAL . 22.2 pt -65.18 -20.82 28.24 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.282 0 CA-C-O 120.609 0.242 . . . . 0.5 111.167 -179.297 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -62.86 -26.8 68.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.687 0.755 . . . . 1.0 109.677 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -101.59 2.94 39.48 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.469 -0.787 . . . . 1.14 110.785 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -116.65 -15.87 10.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.134 -0.485 . . . . 1.33 111.281 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -95.1 125.63 49.77 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.22 -0.446 . . . . 1.39 111.193 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -61.79 174.5 2.28 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.719 2.279 . . . . 1.47 112.042 178.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.416 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 14.6 ptt-85 -49.95 -33.46 17.71 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.835 0.68 . . . . 4.87 112.835 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -75.07 -52.77 10.22 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.928 -0.309 . . . . 2.58 111.683 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 35.5 mt -66.75 -35.63 80.56 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.225 0.454 . . . . 0.85 112.225 -178.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -65.83 -30.18 70.76 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.857 -0.337 . . . . 2.36 110.821 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 100' ' ' ARG . 43.1 mtmt -68.63 -23.87 64.48 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.329 0.585 . . . . 2.57 109.748 178.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 52.9 mttp -84.14 -28.95 27.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.446 -0.797 . . . . 2.44 108.977 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 26.1 tp -64.51 -45.33 87.74 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.498 -0.774 . . . . 1.27 109.823 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 1.4 p -63.87 -25.87 68.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 1.15 110.674 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 39.3 mtt-85 -72.61 -24.35 61.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.949 -0.569 . . . . 3.6 110.982 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.5 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 49.0 t -91.48 -48.77 13.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 116.081 -0.509 . . . . 1.25 110.105 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 71.8 t -56.66 -44.36 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.67 -0.695 . . . . 1.11 112.187 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.93 -38.46 91.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.616 0.246 . . . . 1.74 111.256 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 57.9 mt -71.02 -40.05 75.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.801 0.334 . . . . 1.21 110.777 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 89.5 mt -58.72 -39.52 81.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 1.33 111.913 -179.237 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 11.7 ptpt -83.08 -40.86 19.3 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.976 -0.289 . . . . 1.69 111.759 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -66.71 -33.83 76.49 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.034 0.383 . . . . 2.2 112.034 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.7 mmm180 -85.73 0.04 53.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.751 -0.204 . . . . 3.23 110.993 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 56.14 52.03 10.95 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.33 0.586 . . . . 2.0 110.116 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 49.7 mm -77.35 -49.12 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.837 -0.62 . . . . 0.61 110.481 -179.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -102.25 171.98 7.16 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.087 -0.506 . . . . 1.26 110.327 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.22 158.83 35.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.998 -0.547 . . . . 1.3 110.341 179.374 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.417 ' O ' ' HB2' ' A' ' 125' ' ' ASN . 2.0 mmmt -57.41 -39.82 76.99 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.515 -0.311 . . . . 2.85 111.584 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -66.66 -27.77 67.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.749 0.309 . . . . 2.95 111.141 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 90.0 t -80.73 -51.22 16.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.47 -0.332 . . . . 1.28 111.243 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.516 ' O ' ' HG2' ' A' ' 128' ' ' GLU . 26.9 m -61.74 -30.2 47.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.772 0.32 . . . . 1.23 111.131 -179.451 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -72.29 -27.32 62.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.208 -0.451 . . . . 1.74 110.654 179.589 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -79.16 -36.27 40.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.187 -0.46 . . . . 1.44 110.023 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 81.3 mt -63.4 -54.61 30.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.873 -0.603 . . . . 0.47 111.049 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 124' ' ' VAL . 5.2 pt-20 -61.59 -38.68 88.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.351 -0.386 . . . . 2.05 111.794 -178.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -68.15 -29.25 68.1 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.751 -0.38 . . . . 3.98 110.724 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 65.0 m -72.17 -40.36 68.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.839 0.352 . . . . 0.7 110.161 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.1 mp -64.12 -39.42 93.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.191 0.519 . . . . 1.33 109.922 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.05 -42.28 63.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.502 -0.772 . . . . 0.69 111.213 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.44 -25.58 67.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.84 111.274 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -72.6 -15.45 61.74 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.096 -0.502 . . . . 1.12 110.75 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 32.0 mt 64.19 12.29 6.98 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.932 -0.576 . . . . 4.04 111.637 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -102.78 68.62 1.03 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.259 0.552 . . . . 6.64 110.574 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 . . . . . 0 C--O 1.244 0.783 0 CA-C-O 118.442 -0.789 . . . . 8.0 109.867 179.683 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 206' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo . . . . . 0 CA--C 1.533 0.44 0 CA-C-O 120.086 -0.048 . . . . 7.47 112.193 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 18.5 m 67.4 99.94 0.05 Allowed 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.745 0.783 . . . . 6.02 112.231 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 208' ' ' TYR . . . . . 0.512 ' HA ' ' OE1' ' A' ' 19' ' ' GLN . 28.7 t80 -71.09 128.42 35.89 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.705 -0.679 . . . . 4.07 109.958 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 209' ' ' SEP . . . . . 0.409 ' HA ' ' HD3' ' B' ' 210' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 210' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' B' ' 209' ' ' SEP . 31.4 Cg_exo -60.18 -30.27 90.92 Favored 'Trans proline' 0 N--CA 1.476 0.463 0 C-N-CA 122.813 2.342 . . . . 4.35 112.934 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -91.11 -8.5 48.65 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.099 -0.501 . . . . 4.95 110.889 -179.402 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 72.6 m -134.76 78.52 54.92 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 109.63 -0.507 . . . . 3.16 109.63 179.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 213' ' ' PRO . . . . . 0.427 ' HA ' ' CE2' ' B' ' 208' ' ' TYR . 11.3 Cg_exo -71.66 -24.1 22.17 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 123.193 2.595 . . . . 4.03 113.139 -178.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 3.4 m . . . . . 0 C--O 1.251 1.147 0 CA-C-O 118.342 -0.837 . . . . 5.57 110.428 -179.464 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.206 0 CA-C-O 120.857 0.361 . . . . 5.47 111.003 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -88.9 160.53 17.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.335 -0.393 . . . . 5.34 110.521 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.13 103.41 0.61 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.892 -0.595 . . . . 2.73 111.273 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.3 m -80.6 157.02 26.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.856 -0.611 . . . . 3.24 110.276 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 58.71 39.39 24.4 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.287 -0.415 . . . . 2.9 111.231 -179.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.481 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 18.5 mt-30 -60.8 -38.44 85.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.29 -0.414 . . . . 2.75 111.521 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.618 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 82.4 t80 -77.12 -43.94 32.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.039 0.447 . . . . 0.91 110.785 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.0 -41.22 96.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.907 -0.588 . . . . 0.86 112.358 -179.276 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.9 t -69.39 -24.39 63.86 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.709 -0.223 . . . . 1.42 111.408 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 71.2 mmtt -68.11 -37.62 81.35 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.973 0.416 . . . . 1.3 110.052 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -62.22 -32.59 73.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.602 -0.726 . . . . 1.57 111.153 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 54.8 m-20 -77.57 -11.32 59.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.108 -0.496 . . . . 1.59 111.287 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.99 9.66 18.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.843 0.354 . . . . 1.63 111.465 -179.327 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 15' ' ' LEU . 17.9 mt -85.94 165.0 17.1 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.129 0.49 . . . . 1.1 111.372 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -144.18 169.58 17.61 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.581 -0.736 . . . . 2.16 109.458 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -84.38 41.9 0.86 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.425 0.631 . . . . 1.94 111.453 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -119.33 139.23 52.3 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.991 -0.55 . . . . 1.61 109.708 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' B' ' 213' ' ' PRO . 5.2 pm0 -61.39 -39.58 91.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.679 -0.237 . . . . 2.64 111.016 -179.097 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.77 -42.22 99.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.123 0.487 . . . . 2.99 110.258 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.8 m -65.28 -46.98 78.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.025 -0.534 . . . . 1.1 111.012 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 38.4 mm -65.39 -44.98 94.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 CA-C-N 116.354 -0.384 . . . . 0.88 110.235 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.9 t -56.18 -43.38 78.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.876 -0.602 . . . . 1.18 111.082 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.0 m -59.21 -36.85 76.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.247 -0.433 . . . . 1.16 111.868 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -83.01 -40.52 19.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.767 0.318 . . . . 0.45 111.111 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.6 m -62.29 -43.64 98.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.301 -0.409 . . . . 1.32 111.038 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.623 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 0.3 OUTLIER -64.06 -38.74 92.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.318 -0.401 . . . . 2.38 110.095 179.67 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 37.5 t90 -64.89 -38.57 91.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.025 -0.534 . . . . 0.98 110.287 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -67.09 -45.31 77.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.98 -0.555 . . . . 1.3 111.142 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 74.1 mt -64.26 -21.37 66.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.961 -0.563 . . . . 1.06 112.052 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 66.0 mt -70.64 -24.45 62.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.752 0.311 . . . . 1.71 110.991 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.15 72.08 1.45 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.087 0.47 . . . . 1.51 110.991 -179.573 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.5 p90 -75.17 9.18 2.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.94 -0.573 . . . . 1.61 110.729 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 33.1 mtp-105 -71.0 -25.1 62.54 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.782 -0.644 . . . . 3.97 110.499 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -117.13 33.3 5.69 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.128 -0.487 . . . . 1.7 110.645 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.428 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -54.62 -51.65 76.71 Favored Pre-proline 0 CA--C 1.538 0.485 0 CA-C-N 115.512 -0.767 . . . . 0.43 112.282 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.428 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 35.5 Cg_endo -66.03 -29.49 48.62 Favored 'Trans proline' 0 C--N 1.356 0.936 0 C-N-CA 121.602 1.535 . . . . 0.5 112.182 179.458 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.6 tptm -70.58 -45.96 64.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.46 -0.336 . . . . 2.78 110.867 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 35.5 m -72.64 -25.79 23.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 120.837 -0.345 . . . . 0.39 110.49 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.37 -50.12 49.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 0.32 110.655 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -66.67 -35.32 79.86 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 110.207 -0.294 . . . . 1.4 110.207 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.618 ' SD ' ' HB3' ' A' ' 8' ' ' PHE . 57.0 ttm -66.48 -40.82 89.52 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.02 0.438 . . . . 1.51 109.839 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -60.29 -49.13 78.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.508 -0.769 . . . . 0.41 109.503 178.461 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -57.39 -46.68 83.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.092 -0.958 . . . . 1.11 110.837 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -62.97 -43.89 97.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.801 -0.636 . . . . 1.96 111.413 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.43 ' O ' HG21 ' A' ' 52' ' ' VAL . 81.2 t80 -64.67 -45.14 87.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.884 0.373 . . . . 1.58 111.227 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 56.4 mmm -67.4 -22.53 65.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.138 -0.483 . . . . 0.7 112.051 -178.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.7 mt -103.72 32.35 3.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.917 0.389 . . . . 0.88 111.579 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 59.3 mtp180 -113.76 144.02 30.64 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 116.364 -0.38 . . . . 2.69 110.567 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.35 -16.31 31.18 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.833 2.355 . . . . 0.94 112.613 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.05 4.8 21.58 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.014 -0.539 . . . . 1.33 111.255 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.43 HG21 ' O ' ' A' ' 46' ' ' TYR . 41.3 t -115.33 120.9 66.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.299 -0.41 . . . . 0.59 110.789 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -74.41 155.16 38.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.842 -0.617 . . . . 1.8 110.614 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.65 -36.96 62.67 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 122.876 0.47 . . . . 0.81 112.214 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -35.02 78.84 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.961 0.41 . . . . 3.58 110.451 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.4 mmm-85 -73.9 -37.21 64.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.079 -0.51 . . . . 3.05 110.544 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 78.3 mttt -65.83 -32.25 73.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.049 -0.523 . . . . 0.59 109.755 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 32.0 tp -66.48 -40.64 89.41 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.072 -0.714 . . . . 1.26 109.072 178.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.6 mp -68.62 -39.81 80.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.503 -0.771 . . . . 1.54 110.187 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.34 -34.89 90.66 Favored Glycine 0 N--CA 1.452 -0.273 0 N-CA-C 111.58 -0.608 . . . . 0.37 111.58 179.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.2 tt -66.62 -39.97 88.58 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.335 -0.617 . . . . 1.23 109.335 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -61.32 -40.27 93.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.592 -0.731 . . . . 1.38 110.823 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.8 tp -62.16 -45.65 92.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.206 -0.452 . . . . 1.45 110.302 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.486 ' O ' HG22 ' A' ' 68' ' ' VAL . 16.0 tmm? -62.93 -47.17 84.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.854 -0.612 . . . . 0.61 109.838 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -56.45 -39.11 72.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.51 -0.768 . . . . 1.69 111.525 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -69.36 -53.0 21.72 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.004 -0.543 . . . . 1.54 111.447 -179.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 34.4 m -63.39 -32.6 57.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 112.731 0.641 . . . . 1.4 112.731 -178.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.486 HG22 ' O ' ' A' ' 64' ' ' MET . 34.5 m -80.07 -31.95 13.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.446 -0.502 . . . . 0.43 111.67 -179.542 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -75.48 -35.74 60.77 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.982 0.42 . . . . 2.02 110.594 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -84.09 -11.65 56.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.209 -0.45 . . . . 2.1 111.315 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.6 -23.46 66.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.445 -0.343 . . . . 0.51 111.087 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.4 ' HD3' HE22 ' A' ' 80' ' ' GLN . 3.4 mmmp? -66.77 -38.36 86.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.253 -0.431 . . . . 2.09 110.386 179.327 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -73.32 -30.52 62.5 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.923 -0.655 . . . . 0.66 111.658 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -81.13 -15.49 55.71 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.817 0.342 . . . . 1.62 110.329 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 62.9 mttp 65.1 26.67 12.51 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.446 -0.797 . . . . 2.7 110.679 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 36.7 mm -109.68 86.37 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.638 -0.71 . . . . 0.63 109.423 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.409 HG13 ' OE1' ' A' ' 78' ' ' GLN . 2.0 pp -73.11 -12.05 15.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.123 -0.489 . . . . 0.86 110.753 -179.35 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.409 ' OE1' HG13 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -59.74 -35.57 74.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.962 -0.563 . . . . 2.22 110.165 179.321 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.51 -43.7 89.25 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.299 0.571 . . . . 1.34 109.5 178.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.4 HE22 ' HD3' ' A' ' 72' ' ' LYS . 75.2 mt-30 -68.92 -36.97 78.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.194 -0.912 . . . . 1.3 111.191 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.406 ' O ' ' HG2' ' A' ' 85' ' ' LYS . 30.2 t70 -69.96 -43.95 70.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.901 0.382 . . . . 1.32 110.931 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.43 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 39.8 m -62.87 -44.44 96.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.052 -0.522 . . . . 0.94 111.193 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -79.22 -33.39 43.76 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-N 116.318 -0.401 . . . . 1.23 111.297 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.15 -44.27 94.9 Favored Glycine 0 N--CA 1.453 -0.226 0 N-CA-C 114.211 0.445 . . . . 0.34 114.211 -178.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.43 ' HE2' ' HA ' ' A' ' 82' ' ' SER . 0.0 OUTLIER -66.18 -20.88 66.27 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.204 0.446 . . . . 1.31 112.204 -178.772 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 20.4 m -106.41 -17.2 7.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.898 0.38 . . . . 0.38 110.902 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.76 -46.98 85.52 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.131 -0.486 . . . . 0.38 111.011 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.49 -40.43 71.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.254 -0.43 . . . . 0.45 110.735 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -66.27 -58.61 4.98 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.805 -0.634 . . . . 1.56 110.169 179.426 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.514 ' O ' HG12 ' A' ' 94' ' ' ILE . 81.7 t -56.02 -49.72 73.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.945 -0.571 . . . . 0.34 111.905 -178.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 94.8 mt -59.03 -43.45 91.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.817 -0.174 . . . . 1.45 111.424 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -65.82 -32.29 82.39 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.757 -0.735 . . . . 0.41 112.401 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 34.7 mmm-85 -77.55 -52.93 8.24 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.528 0.204 . . . . 3.46 111.245 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.514 HG12 ' O ' ' A' ' 90' ' ' VAL . 37.9 pt -66.97 -18.8 24.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.452 -0.34 . . . . 0.5 111.361 -179.048 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -61.64 -30.93 71.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.394 0.616 . . . . 1.0 109.812 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -85.74 -14.98 43.62 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.576 -0.738 . . . . 1.14 110.375 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -92.11 -38.12 12.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.907 -0.588 . . . . 1.33 110.773 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 -67.28 122.03 81.16 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.566 -0.743 . . . . 1.39 111.383 -179.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -71.85 -175.88 1.84 Allowed 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.476 2.117 . . . . 1.47 112.337 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 15.9 ptt-85 -55.56 -27.37 48.76 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 113.119 0.785 . . . . 4.87 113.119 -178.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.44 ' HA ' ' CE ' ' A' ' 104' ' ' LYS . 33.4 t70 -81.15 -46.09 15.42 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.654 -0.418 . . . . 2.58 111.845 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 22.5 mt -73.86 -29.2 61.97 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.363 0.505 . . . . 0.85 112.363 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 57.1 pttt -58.85 -28.42 66.06 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.792 0.329 . . . . 2.36 111.149 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.44 ' CE ' ' HA ' ' A' ' 101' ' ' ASP . 41.0 mtmt -64.42 -50.91 65.72 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.04 0.448 . . . . 2.57 110.599 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 40.9 mttp -68.47 -33.55 74.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.854 -0.612 . . . . 2.44 110.093 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 16.6 tp -63.39 -48.26 78.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.717 -0.674 . . . . 1.27 110.641 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.8 p -66.57 -33.57 75.96 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.941 -0.304 . . . . 1.15 110.796 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 39.0 mtt180 -64.08 -52.43 59.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.157 -0.474 . . . . 3.6 111.472 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.482 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 6.2 p -61.48 -42.17 92.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 121.085 -0.246 . . . . 1.25 110.961 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 50.5 t -60.4 -43.89 94.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 121.017 0.437 . . . . 1.11 110.175 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.424 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 2.7 t-20 -60.11 -47.34 86.29 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.589 -0.732 . . . . 1.74 110.693 179.683 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 78.8 mt -63.59 -44.35 98.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.305 -0.407 . . . . 1.21 111.139 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 87.1 mt -60.28 -44.01 95.73 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.973 0.36 . . . . 1.33 111.973 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.424 ' HG3' ' O ' ' A' ' 111' ' ' ASN . 2.0 ptpt -75.1 -35.4 61.76 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.91 -0.316 . . . . 1.69 111.506 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -71.07 -27.07 63.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.634 0.255 . . . . 2.2 111.282 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 6.4 mtt-85 -90.76 -4.0 57.0 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.67 -0.493 . . . . 3.23 109.67 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 56.09 54.89 7.37 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.089 -0.959 . . . . 2.0 110.16 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 37.8 mm -73.86 -45.83 48.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.344 -0.844 . . . . 0.61 110.602 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -100.31 171.53 7.72 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.966 -0.561 . . . . 1.26 110.736 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.8 163.08 20.09 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.931 -0.577 . . . . 1.3 111.224 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.3 mmmp? -55.4 -43.38 75.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 2.85 111.683 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.92 -23.05 64.12 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.016 -0.538 . . . . 2.95 111.659 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 61.4 t -85.19 -49.18 15.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 121.144 -0.223 . . . . 1.28 111.26 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 27.8 m -61.17 -30.54 48.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.883 0.373 . . . . 1.23 111.181 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -80.84 -28.46 36.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 1.74 110.86 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.45 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 10.9 t70 -73.41 -40.55 64.18 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.017 0.437 . . . . 1.44 110.179 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 91.0 mt -60.62 -52.51 60.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.98 -0.555 . . . . 0.47 111.526 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -63.11 -33.98 76.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.227 0.454 . . . . 2.05 112.227 -178.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 13.1 ptt180 -74.81 -33.81 62.26 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.426 -0.51 . . . . 3.98 110.943 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 39.3 m -66.04 -44.62 84.1 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.983 0.42 . . . . 0.7 110.734 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.5 mp -62.04 -36.83 82.77 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.119 -0.491 . . . . 1.33 110.447 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.36 -41.15 66.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.785 -0.643 . . . . 0.69 110.851 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.05 -34.11 74.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.366 -0.379 . . . . 0.84 111.432 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.18 -19.37 63.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.447 . . . . 1.12 111.177 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 55.7 mt 53.79 45.01 28.77 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.913 -0.585 . . . . 4.04 111.819 179.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -107.11 35.11 3.15 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.341 0.591 . . . . 6.64 109.746 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.736 -0.65 . . . . 8.0 109.893 179.943 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 206' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo . . . . . 0 N--CA 1.482 0.817 0 N-CA-C 111.67 -0.165 . . . . 7.47 111.67 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 48.9 m 63.38 102.88 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.982 0.896 . . . . 6.02 112.246 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -81.26 130.23 34.94 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.576 -0.738 . . . . 4.07 111.128 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 209' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_exo -58.0 -24.13 63.85 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.07 2.513 . . . . 4.35 112.715 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 1.5 m -81.4 -8.42 59.73 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.236 0.541 . . . . 4.95 110.523 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 10.0 m -134.52 71.44 71.35 Favored Pre-proline 0 C--O 1.236 0.387 0 CA-C-N 116.181 -0.463 . . . . 3.16 110.394 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 213' ' ' PRO . . . . . 0.422 ' O ' ' HB2' ' A' ' 19' ' ' GLN . 27.6 Cg_endo -61.67 -42.91 29.33 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.857 2.372 . . . . 4.03 112.814 -179.171 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.304 -0.855 . . . . 5.57 108.916 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 120.514 0.197 . . . . 5.47 110.797 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -91.67 167.74 11.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.99 0.424 . . . . 5.34 110.577 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m -81.79 67.59 7.83 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.273 -0.421 . . . . 2.73 110.504 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.43 -21.48 66.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.039 0.447 . . . . 3.24 110.782 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -67.13 -14.94 63.39 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.735 -0.666 . . . . 2.9 111.54 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.429 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 97.0 mt-30 -64.34 -31.33 72.49 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.091 0.472 . . . . 2.75 109.737 179.111 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -72.6 -49.57 31.24 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.86 -0.609 . . . . 0.91 110.11 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -36.67 80.21 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.784 -0.644 . . . . 0.86 112.015 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.1 t -72.66 -26.95 61.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.455 -0.339 . . . . 1.42 110.674 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.429 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 22.6 mmmt -69.37 -27.78 65.62 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-O 120.701 0.286 . . . . 1.3 110.589 179.542 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.86 -29.87 71.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.956 -0.566 . . . . 1.57 110.577 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -81.48 -20.8 39.44 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.054 -0.521 . . . . 1.59 110.496 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.2 p -101.16 24.69 9.09 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.066 -0.515 . . . . 1.63 111.554 -179.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 15' ' ' LEU . 15.8 mt -77.36 165.44 24.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.037 0.446 . . . . 1.1 111.373 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -144.88 168.25 20.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.82 -0.627 . . . . 2.16 109.377 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -82.62 -20.85 35.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.663 0.268 . . . . 1.94 111.316 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.455 ' HB2' ' OG ' ' A' ' 21' ' ' SER . 3.5 m -61.61 133.87 56.15 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 1.61 111.082 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.02 -34.89 79.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.85 -0.614 . . . . 2.64 110.554 -178.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -66.15 -38.66 88.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.821 -0.627 . . . . 2.99 110.745 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.455 ' OG ' ' HB2' ' A' ' 18' ' ' SER . 4.3 m -68.16 -38.9 82.61 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.147 -0.479 . . . . 1.1 110.163 179.699 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.9 mm -67.32 -34.97 72.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 N-CA-C 109.047 -0.723 . . . . 0.88 109.047 178.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.0 m -63.26 -33.78 76.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.185 -0.916 . . . . 1.18 111.179 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.1 m -62.43 -47.58 83.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 1.16 110.722 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.35 -40.66 81.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.101 -0.5 . . . . 0.45 110.632 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 29.1 t -61.32 -48.89 79.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.025 -0.534 . . . . 1.32 110.771 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -26.8 68.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 2.38 111.1 -179.583 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 13.9 t90 -78.15 -37.83 45.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.153 -0.476 . . . . 0.98 110.169 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -67.52 -35.4 79.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.669 -0.696 . . . . 1.3 110.911 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.7 -23.9 67.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.408 -0.36 . . . . 1.06 111.774 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 68.4 mt -81.09 -20.75 40.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.074 0.464 . . . . 1.71 111.065 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -110.27 41.45 1.74 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.11 0.481 . . . . 1.51 110.443 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 54.6 p90 -59.11 -20.6 54.95 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.802 -0.635 . . . . 1.61 112.098 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.3 ttp180 -71.47 -25.49 62.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.034 0.445 . . . . 3.97 110.711 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.33 16.97 25.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.897 -0.592 . . . . 1.7 110.739 -179.464 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.503 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.38 -50.88 77.27 Favored Pre-proline 0 CA--C 1.536 0.404 0 CA-C-N 115.735 -0.666 . . . . 0.43 112.51 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 18.1 Cg_endo -59.81 -31.69 94.32 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 121.83 1.687 . . . . 0.5 112.708 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.3 tptt -76.57 -41.22 47.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.318 -0.401 . . . . 2.78 111.345 -178.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.1 m -73.17 -29.77 29.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 C-N-CA 120.396 -0.522 . . . . 0.39 110.546 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.83 -46.41 71.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.185 -0.461 . . . . 0.32 111.34 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 7.4 pt-20 -64.84 -40.78 95.72 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 110.049 -0.352 . . . . 1.4 110.049 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 65.7 mtm -65.47 -37.31 86.47 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.961 0.41 . . . . 1.51 109.945 179.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 63.5 t90 -59.55 -48.27 82.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.493 -0.776 . . . . 0.41 109.742 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.405 ' HE3' HD12 ' A' ' 48' ' ' LEU . 8.9 ttpt -60.83 -45.07 95.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.209 -0.451 . . . . 1.11 110.676 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.536 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 10.0 mm-40 -60.53 -47.09 87.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.963 -0.562 . . . . 1.96 110.851 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -65.43 -44.18 88.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 1.58 111.115 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 70.3 mmm -66.16 -22.98 66.39 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.104 0.409 . . . . 0.7 112.104 -179.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.405 HD12 ' HE3' ' A' ' 44' ' ' LYS . 51.3 mt -99.68 7.47 45.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.602 0.239 . . . . 0.88 111.487 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.536 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 41.9 mtp180 -84.92 132.57 45.49 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.954 -0.387 . . . . 2.69 109.954 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -67.07 -11.69 33.23 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.754 2.303 . . . . 0.94 112.59 -179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -16.43 59.24 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.171 0.51 . . . . 1.33 110.6 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.2 t -92.18 123.87 44.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.799 -0.637 . . . . 0.59 110.769 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -69.61 153.31 43.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.795 -0.639 . . . . 1.8 110.601 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.35 -39.69 64.35 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.017 -0.538 . . . . 0.81 112.354 -179.477 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -68.82 -32.6 72.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.845 0.355 . . . . 3.58 110.954 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.7 mmt85 -71.45 -32.65 68.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.314 -0.403 . . . . 3.05 110.016 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.1 mttt -67.65 -34.29 76.66 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.452 -0.573 . . . . 0.59 109.452 178.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 40.8 tp -63.3 -43.64 97.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.773 -0.648 . . . . 1.26 109.797 178.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 94.1 mt -65.47 -40.76 93.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.812 -0.631 . . . . 1.54 110.034 179.01 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.9 -30.69 78.46 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.983 -0.627 . . . . 0.37 111.743 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 25.8 tp -71.78 -38.82 70.25 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.918 0.389 . . . . 1.23 110.138 178.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -65.96 -31.37 72.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.961 -0.563 . . . . 1.38 110.568 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 56.7 tp -65.73 -44.5 85.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.956 -0.565 . . . . 1.45 110.627 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.474 ' HG3' ' N ' ' A' ' 65' ' ' ASN . 0.0 OUTLIER -67.13 -34.61 77.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.61 110.841 -179.61 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.474 ' N ' ' HG3' ' A' ' 64' ' ' MET . 11.2 t30 -63.44 -37.29 86.73 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.343 0.592 . . . . 1.69 110.528 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -68.22 -52.87 29.3 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.382 -0.826 . . . . 1.54 111.295 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.417 HG12 ' HA ' ' A' ' 64' ' ' MET . 7.1 p -63.43 -39.42 85.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 112.9 0.704 . . . . 1.4 112.9 -177.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.465 HG22 ' O ' ' A' ' 64' ' ' MET . 33.5 m -73.57 -24.58 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 C-N-CA 120.416 -0.514 . . . . 0.43 111.517 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -75.18 -47.66 27.3 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.111 -0.329 . . . . 2.02 110.111 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -72.08 -23.16 61.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.186 -0.461 . . . . 2.1 110.732 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.09 -29.09 70.07 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-N 116.392 -0.367 . . . . 0.51 111.125 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.479 ' HD2' ' HA ' ' A' ' 118' ' ' ILE . 42.8 mtpt -68.01 -34.88 77.34 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.441 -0.345 . . . . 2.09 110.371 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.46 -30.4 75.08 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.924 -0.655 . . . . 0.66 111.753 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -95.62 -2.09 48.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.731 0.3 . . . . 1.62 110.447 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm 62.01 23.75 14.04 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.686 -0.688 . . . . 2.7 112.121 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 23.3 mm -86.36 78.91 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.861 -0.422 . . . . 0.63 109.861 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 10.3 pt -64.42 -11.71 10.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.861 -0.609 . . . . 0.86 111.71 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.96 -26.75 68.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.095 -0.502 . . . . 2.22 110.492 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -73.5 -51.23 17.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 1.34 110.865 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -63.96 -28.65 69.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 1.3 111.311 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -73.24 -50.28 23.22 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.208 0.527 . . . . 1.32 109.968 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.436 ' HA ' ' HE3' ' A' ' 85' ' ' LYS . 23.4 m -64.4 -47.1 80.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.455 -0.793 . . . . 0.94 111.65 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -76.77 -30.22 56.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.605 0.24 . . . . 1.23 111.308 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.7 -42.21 93.38 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.078 -0.582 . . . . 0.34 113.479 -179.158 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.436 ' HE3' ' HA ' ' A' ' 82' ' ' SER . 9.7 ptpt -60.55 -27.06 67.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.752 0.276 . . . . 1.31 111.539 -179.152 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.416 HG13 ' HG3' ' A' ' 85' ' ' LYS . 17.1 m -103.29 -14.64 8.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.707 0.289 . . . . 0.38 111.564 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.74 -44.61 93.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.427 -0.351 . . . . 0.38 111.323 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.27 -36.81 69.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.098 0.475 . . . . 0.45 111.016 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 5.8 tp10 -72.69 -58.61 3.22 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.598 -0.728 . . . . 1.56 110.62 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 96.2 t -54.91 -50.34 62.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.85 -0.614 . . . . 0.34 112.107 -178.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.534 HD13 HD11 ' A' ' 94' ' ' ILE . 3.3 mm? -58.24 -42.22 85.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.531 0.205 . . . . 1.45 111.355 -179.119 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -67.66 -35.06 85.24 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.573 -0.823 . . . . 0.41 112.426 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 15.8 mmp_? -75.68 -48.76 20.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.548 0.213 . . . . 3.46 111.566 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.534 HD11 HD13 ' A' ' 91' ' ' LEU . 43.5 pt -65.97 -25.46 36.09 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 C-N-CA 121.062 -0.255 . . . . 0.5 111.589 -178.535 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -63.15 -21.79 66.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.432 0.634 . . . . 1.0 110.189 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -97.27 -33.73 11.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.722 -0.672 . . . . 1.14 110.804 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -76.3 -32.83 58.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 1.33 111.055 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -80.82 132.83 56.4 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.12 -0.491 . . . . 1.39 110.226 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.408 ' HD2' HD12 ' A' ' 102' ' ' LEU . 28.7 Cg_endo -63.42 166.35 15.41 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.352 2.035 . . . . 1.47 110.835 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.483 ' HA ' ' HG2' ' A' ' 103' ' ' LYS . 0.0 OUTLIER -59.44 -21.61 60.28 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.945 0.35 . . . . 4.87 111.945 -178.758 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.27 -25.79 51.8 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.831 0.348 . . . . 2.58 110.969 179.704 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.408 HD12 ' HD2' ' A' ' 99' ' ' PRO . 26.4 mt -98.66 -26.81 14.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.575 -0.284 . . . . 0.85 111.736 -178.699 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LYS . . . . . 0.483 ' HG2' ' HA ' ' A' ' 100' ' ' ARG . 0.0 OUTLIER -61.13 -25.19 66.82 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.002 0.429 . . . . 2.36 110.541 -179.87 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.548 ' O ' ' HG3' ' A' ' 108' ' ' ARG . 53.2 mttm -65.48 -35.39 80.77 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.028 -0.533 . . . . 2.57 110.216 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 18.5 mtpp -69.94 -49.89 47.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.945 -0.57 . . . . 2.44 110.925 -179.23 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.478 ' CD2' ' HA ' ' A' ' 103' ' ' LYS . 3.2 pp -65.78 -27.92 68.63 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.684 0.278 . . . . 1.27 110.657 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.1 t -63.78 -37.64 88.13 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.265 -0.425 . . . . 1.15 110.03 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 104' ' ' LYS . 8.3 mtp85 -66.42 -40.66 89.69 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.423 -0.584 . . . . 3.6 109.423 179.18 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.583 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 47.3 t -59.56 -56.95 13.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.159 -0.928 . . . . 1.25 110.732 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 44.7 t -57.85 -41.19 79.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.078 -0.51 . . . . 1.11 111.13 -179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -58.92 -49.08 79.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.301 -0.409 . . . . 1.74 110.524 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 96.9 mt -65.18 -38.3 82.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.712 0.291 . . . . 1.21 110.685 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 96.0 mt -59.67 -43.21 94.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.312 -0.404 . . . . 1.33 111.231 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -79.94 -33.25 39.81 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.899 -0.321 . . . . 1.69 111.07 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -66.0 -44.7 84.01 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.717 0.294 . . . . 2.2 111.022 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 85.8 mtt180 -87.03 7.27 28.44 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.548 -0.296 . . . . 3.23 111.103 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 47.84 58.89 4.59 Favored 'General case' 0 C--O 1.235 0.315 0 O-C-N 123.77 0.669 . . . . 2.0 110.84 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.479 ' HA ' ' HD2' ' A' ' 72' ' ' LYS . 40.4 mm -73.65 -48.02 42.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.855 -0.612 . . . . 0.61 110.939 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -101.93 174.76 5.8 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.024 -0.535 . . . . 1.26 110.838 -179.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' SER . . . . . 0.42 ' O ' HG23 ' A' ' 124' ' ' VAL . 26.7 t -71.18 139.6 50.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.058 -0.519 . . . . 1.3 109.761 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -53.23 -30.35 37.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.417 -0.356 . . . . 2.85 111.712 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -61.92 -49.48 76.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.93 0.395 . . . . 2.95 111.132 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.533 ' O ' HG13 ' A' ' 127' ' ' ILE . 3.9 p -79.22 -27.89 13.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.301 -0.409 . . . . 1.28 111.032 -179.335 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 120' ' ' SER . 43.3 t -60.98 -42.21 92.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.206 0.527 . . . . 1.23 109.81 179.164 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -61.88 -37.89 86.27 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.442 -0.799 . . . . 1.74 110.391 179.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -67.35 -36.48 81.5 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.142 -0.481 . . . . 1.44 110.452 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 123' ' ' VAL . 70.1 mt -63.58 -49.33 82.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.084 0.469 . . . . 0.47 109.832 178.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -62.06 -40.1 94.64 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.743 -0.662 . . . . 2.05 110.544 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 41.7 mmt-85 -62.1 -43.47 98.77 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.255 -0.43 . . . . 3.98 110.354 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 50.7 m -64.44 -37.65 88.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.727 -0.67 . . . . 0.7 110.783 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 127' ' ' ILE . 73.5 mt -66.43 -46.01 77.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.35 -0.386 . . . . 1.33 110.88 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.443 ' O ' ' HG3' ' A' ' 136' ' ' GLU . . . -68.14 -29.82 68.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 0.69 111.021 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.77 -21.77 64.85 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.028 -0.533 . . . . 0.84 111.727 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -73.82 -18.67 60.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.421 . . . . 1.12 111.108 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.65 20.99 10.19 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.886 0.374 . . . . 4.04 111.063 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 132' ' ' ALA . 65.9 mt-10 -82.98 -4.89 58.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.158 0.504 . . . . 6.64 110.351 179.068 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 81.1 t60 . . . . . 0 C--O 1.244 0.8 0 CA-C-O 118.141 -0.933 . . . . 8.0 109.239 179.225 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 206' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_exo . . . . . 0 N--CA 1.475 0.431 0 N-CA-C 112.679 0.223 . . . . 7.47 112.679 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 49.4 m 65.05 98.02 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.413 0.625 . . . . 6.02 111.552 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -53.98 123.06 11.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.099 -0.5 . . . . 4.07 111.63 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 209' ' ' SEP . . . . . 0.417 ' HA ' ' HD3' ' B' ' 210' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 210' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' B' ' 209' ' ' SEP . 35.6 Cg_exo -60.2 -25.74 80.8 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.743 2.295 . . . . 4.35 112.552 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.83 2.64 56.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.267 0.556 . . . . 4.95 111.104 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 6.7 m -144.51 81.07 11.4 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 116.18 -0.463 . . . . 3.16 109.777 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 213' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -70.39 -55.31 0.16 Allowed 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.42 2.08 . . . . 4.03 113.258 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.199 0 CA-C-O 118.03 -0.986 . . . . 5.57 110.241 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.927 0 CA-C-O 120.739 0.305 . . . . 5.47 110.541 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -116.67 152.65 33.82 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.123 -0.49 . . . . 5.34 110.066 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.6 m -141.78 95.23 2.78 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.866 0.365 . . . . 2.73 110.607 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.9 m -75.17 -19.33 59.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.867 -0.606 . . . . 3.24 109.794 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -84.57 16.1 3.39 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.64 -0.709 . . . . 2.9 110.151 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.417 ' O ' HG22 ' A' ' 10' ' ' THR . 9.8 pt20 -60.05 -33.22 71.76 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.706 -0.679 . . . . 2.75 111.252 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -75.16 -43.0 54.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.979 0.418 . . . . 0.91 110.052 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.97 -39.16 93.85 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.978 -0.556 . . . . 0.86 111.438 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.417 HG22 ' O ' ' A' ' 7' ' ' GLN . 1.2 t -69.83 -24.12 63.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.45 -0.341 . . . . 1.42 110.783 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -71.9 -36.83 70.14 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 109.996 -0.372 . . . . 1.3 109.996 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -68.08 -26.99 66.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.951 -0.568 . . . . 1.57 110.508 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -70.28 -34.34 72.66 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.742 -0.663 . . . . 1.59 110.464 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.6 t -105.2 17.19 24.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.903 -0.59 . . . . 1.63 110.442 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.2 126.88 31.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.863 -0.608 . . . . 1.1 110.291 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -115.29 151.99 33.56 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.663 -0.699 . . . . 2.16 109.557 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -80.19 40.53 0.49 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.506 0.67 . . . . 1.94 111.119 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.532 ' O ' HG12 ' A' ' 22' ' ' ILE . 3.5 m -107.18 146.66 31.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.561 -0.745 . . . . 1.61 110.063 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.1 -32.96 74.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.066 -0.515 . . . . 2.64 110.16 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -66.59 -49.67 65.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.069 -0.514 . . . . 2.99 109.838 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.46 ' OG ' ' HB2' ' A' ' 18' ' ' SER . 1.2 m -56.6 -48.77 76.71 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.905 -0.588 . . . . 1.1 111.777 -179.321 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.532 HG12 ' O ' ' A' ' 18' ' ' SER . 9.4 mm -64.44 -45.8 94.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.577 -0.283 . . . . 0.88 110.979 -179.595 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.7 m -66.4 -39.44 89.03 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 111.827 0.306 . . . . 1.18 111.827 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.0 t -59.64 -47.33 86.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.064 0.459 . . . . 1.16 110.152 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.36 -34.0 72.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.968 -0.56 . . . . 0.45 110.799 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.5 t -59.06 -52.67 64.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.175 -0.466 . . . . 1.32 110.283 179.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.7 mmtp -62.97 -37.95 89.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.093 -0.503 . . . . 2.38 110.395 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 20.6 t90 -61.7 -39.05 90.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.505 -0.77 . . . . 0.98 110.303 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 29' ' ' LEU . 2.2 mm? -74.05 -42.23 60.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.715 -0.675 . . . . 1.3 110.515 179.224 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 mp -59.85 -23.26 63.24 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.093 -0.503 . . . . 1.06 111.585 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 78.3 mt -75.82 -32.04 59.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.458 -0.337 . . . . 1.71 110.528 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -103.08 48.12 0.86 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.58 0.705 . . . . 1.51 110.168 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.442 ' HA ' ' CE2' ' A' ' 79' ' ' PHE . 34.0 p90 -57.89 -23.24 52.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.259 -0.882 . . . . 1.61 112.09 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.7 mtp-105 -71.75 -18.73 62.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.912 0.387 . . . . 3.97 111.143 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.04 21.72 16.86 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.941 0.4 . . . . 1.7 110.817 -179.517 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.478 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.26 -49.45 84.9 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 115.446 -0.797 . . . . 0.43 112.521 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.588 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 35.3 Cg_endo -65.46 -34.56 42.66 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 121.548 1.499 . . . . 0.5 112.745 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.4 ttmt -66.47 -47.04 74.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.677 0.275 . . . . 2.78 111.688 -179.007 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.445 ' HA ' ' SD ' ' A' ' 42' ' ' MET . 26.9 m -73.14 -22.93 19.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 C-N-CA 120.777 -0.369 . . . . 0.39 111.053 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.427 ' HA ' ' CE1' ' A' ' 83' ' ' PHE . . . -71.94 -50.1 31.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.391 -0.368 . . . . 0.32 111.029 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 5.0 pt-20 -63.69 -44.32 94.05 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.347 -0.388 . . . . 1.4 111.283 -179.572 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.445 ' SD ' ' HA ' ' A' ' 39' ' ' VAL . 16.5 ptm -65.88 -33.44 75.85 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.484 0.183 . . . . 1.51 110.915 -179.552 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 64.7 t90 -64.94 -45.49 85.56 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.158 -0.682 . . . . 0.41 109.158 178.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.479 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 16.9 ttpt -60.16 -49.5 77.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.277 -0.874 . . . . 1.11 110.426 179.293 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.519 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 6.7 mm-40 -58.48 -42.51 87.71 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.04 0.448 . . . . 1.96 110.58 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -63.66 -42.75 98.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.761 -0.654 . . . . 1.58 111.217 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 71.6 mmm -72.74 -23.6 60.86 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.129 -0.487 . . . . 0.7 112.311 -178.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 71.0 mt -85.27 -16.8 38.92 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 111.942 0.349 . . . . 0.88 111.942 -179.272 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 57.0 mtm180 -70.67 133.85 86.48 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.737 0.304 . . . . 2.69 111.401 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.2 -13.63 20.95 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.858 2.372 . . . . 0.94 112.37 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -9.68 58.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.988 -0.551 . . . . 1.33 110.793 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 34.0 t -104.63 125.81 59.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.796 -0.638 . . . . 0.59 109.743 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -72.74 163.28 28.35 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.057 0.456 . . . . 1.8 111.005 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.22 -34.44 73.66 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.123 0.786 . . . . 0.81 113.123 -178.336 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -62.6 -43.92 97.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.769 0.319 . . . . 3.58 110.68 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -65.28 -37.38 87.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 3.05 110.359 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -65.77 -36.15 82.74 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.908 -0.587 . . . . 0.59 110.327 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 32.9 tp -62.85 -41.32 99.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.125 -0.489 . . . . 1.26 110.032 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.4 mp -69.39 -35.98 76.32 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.03 -0.532 . . . . 1.54 110.16 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.11 -32.46 84.12 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.758 -0.734 . . . . 0.37 111.313 178.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 37.2 tp -68.16 -37.13 80.67 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.97 0.414 . . . . 1.23 110.218 179.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -64.57 -39.47 93.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.842 -0.617 . . . . 1.38 110.499 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.0 tp -63.67 -44.61 93.26 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.082 -0.508 . . . . 1.45 110.481 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.429 ' O ' HG22 ' A' ' 68' ' ' VAL . 13.6 tmm? -60.13 -41.58 92.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.013 -0.54 . . . . 0.61 109.763 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.505 ' O ' ' HB2' ' A' ' 69' ' ' GLN . 1.4 t30 -60.05 -41.74 92.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.601 -0.727 . . . . 1.69 111.301 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -67.79 -47.72 68.32 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.114 0.413 . . . . 1.54 112.114 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 31.1 m -63.33 -32.13 55.35 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 112.669 0.618 . . . . 1.4 112.669 -178.072 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.429 HG22 ' O ' ' A' ' 64' ' ' MET . 34.2 m -88.59 -18.96 7.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.613 -0.435 . . . . 0.43 111.09 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.505 ' HB2' ' O ' ' A' ' 65' ' ' ASN . 6.2 tp-100 -76.77 -49.35 16.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 2.02 110.831 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 55.4 mm-40 -82.16 -6.15 58.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.185 -0.461 . . . . 2.1 111.035 -179.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.3 -33.47 72.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.317 -0.401 . . . . 0.51 111.519 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -67.02 -28.68 68.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.65 -0.25 . . . . 2.09 111.24 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.56 -38.53 95.83 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.918 -0.658 . . . . 0.66 111.93 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -100.57 0.82 40.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.653 0.263 . . . . 1.62 110.743 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? 63.02 37.75 11.47 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.824 -0.626 . . . . 2.7 111.009 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.4 mm -92.32 81.86 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.367 0.603 . . . . 0.63 109.755 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 44.1 pt -73.78 -11.37 14.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.616 -0.72 . . . . 0.86 111.249 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -61.8 -47.57 84.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.11 -0.496 . . . . 2.22 110.628 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.442 ' CE2' ' HA ' ' A' ' 33' ' ' TYR . 8.7 m-85 -64.92 -33.96 77.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.303 -0.408 . . . . 1.34 111.214 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -71.58 -26.49 62.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.989 -0.551 . . . . 1.3 111.32 -179.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -87.26 -41.92 13.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.723 0.297 . . . . 1.32 110.542 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.457 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 35.0 p -67.3 -52.52 39.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.326 -0.397 . . . . 0.94 111.001 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.427 ' CE1' ' HA ' ' A' ' 40' ' ' ALA . 18.9 m-85 -74.31 -31.54 62.52 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.323 -0.398 . . . . 1.23 110.712 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -63.14 -43.64 98.37 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.166 -0.54 . . . . 0.34 113.39 -179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.457 ' HE2' ' HA ' ' A' ' 82' ' ' SER . 0.1 OUTLIER -65.47 -24.79 67.25 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.254 0.465 . . . . 1.31 112.254 -178.627 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.7 m -104.77 -9.86 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 C-N-CA 120.894 -0.322 . . . . 0.38 111.364 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.22 -48.73 80.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.267 -0.424 . . . . 0.38 111.432 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.04 -41.76 88.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.157 -0.474 . . . . 0.45 111.359 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -62.33 -50.31 72.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.888 -0.596 . . . . 1.56 110.464 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 92.9 t -65.32 -41.31 91.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.957 -0.565 . . . . 0.34 110.936 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -60.87 -48.29 82.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.501 -0.318 . . . . 1.45 111.101 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -64.9 -25.47 70.69 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.589 -0.815 . . . . 0.41 111.879 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.599 ' O ' ' HG2' ' A' ' 96' ' ' GLN . 3.8 mmm-85 -78.87 -51.75 9.26 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.435 0.16 . . . . 3.46 111.21 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 46.2 pt -68.09 -22.26 27.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.926 -0.31 . . . . 0.5 111.241 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -65.51 -28.06 68.92 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.927 0.394 . . . . 1.0 110.742 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.599 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 10.0 pt20 -98.49 -11.84 21.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.031 0.443 . . . . 1.14 110.767 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -91.43 -37.61 13.09 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.153 -0.476 . . . . 1.33 110.628 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -72.99 130.2 85.36 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.265 -0.425 . . . . 1.39 109.933 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -52.55 -77.1 0.02 OUTLIER 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 123.317 2.678 . . . . 1.47 113.298 -179.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -155.8 -53.94 0.09 Allowed 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 111.905 0.335 . . . . 4.87 111.905 179.478 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -65.24 -33.38 75.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.038 0.447 . . . . 2.58 110.838 -179.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 79.5 mt -74.13 -39.01 63.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.174 -0.466 . . . . 0.85 110.875 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LYS . . . . . 0.479 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 10.6 ptpt -73.11 -8.75 57.14 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 121.336 0.589 . . . . 2.36 110.392 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -81.05 -10.76 59.64 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.361 -0.836 . . . . 2.57 109.539 178.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -95.26 -30.06 14.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.722 -0.672 . . . . 2.44 111.308 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 103' ' ' LYS . 4.2 pp -69.78 -28.27 65.62 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 121.056 0.455 . . . . 1.27 110.233 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.04 -34.57 76.71 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.979 -0.555 . . . . 1.15 110.126 179.172 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 108' ' ' ARG . 40.0 mmt180 -66.57 -51.62 54.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.556 -0.747 . . . . 3.6 111.051 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.453 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 2.7 p -65.28 -40.26 88.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.423 -0.353 . . . . 1.25 110.699 -179.659 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 6.3 t -62.5 -42.8 97.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.864 0.364 . . . . 1.11 110.046 179.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -59.26 -47.83 83.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.866 -0.607 . . . . 1.74 109.953 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.437 ' O ' ' HG2' ' A' ' 116' ' ' ARG . 96.8 mt -60.7 -49.72 83.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.996 -0.547 . . . . 1.21 111.335 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 96.0 mt -59.87 -39.15 84.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.331 -0.395 . . . . 1.33 111.963 -178.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 4.7 pttp -82.23 -22.93 35.63 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.549 -0.46 . . . . 1.69 111.769 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -78.79 -37.0 41.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.923 0.392 . . . . 2.2 110.48 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 13.4 mmm-85 -84.67 1.37 46.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.083 -0.508 . . . . 3.23 110.288 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 57.79 47.79 14.84 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.435 -0.802 . . . . 2.0 111.034 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 31.6 mm -70.17 -50.45 47.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.907 -0.588 . . . . 0.61 109.801 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -100.38 158.79 15.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.901 -0.591 . . . . 1.26 110.309 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.8 m -67.32 156.02 37.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.194 -0.457 . . . . 1.3 109.945 179.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 61.3 mtpt -55.77 -34.29 65.12 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.945 0.35 . . . . 2.85 111.945 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -59.54 -41.83 90.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.184 0.516 . . . . 2.95 110.02 179.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.429 ' O ' HG13 ' A' ' 127' ' ' ILE . 40.7 t -72.27 -45.01 62.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.578 -0.737 . . . . 1.28 110.301 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 76.8 t -57.87 -44.07 85.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.496 . . . . 1.23 110.932 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 42.4 t-20 -58.01 -45.76 86.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.923 -0.58 . . . . 1.74 110.259 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -62.96 -38.82 92.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.984 -0.553 . . . . 1.44 111.305 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 123' ' ' VAL . 79.9 mt -66.75 -46.67 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.091 0.472 . . . . 0.47 110.775 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 68.5 mt-10 -63.17 -28.86 70.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.151 -0.477 . . . . 2.05 110.952 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 21.5 mtm-85 -81.11 -41.08 23.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.24 -0.437 . . . . 3.98 111.984 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 1.2 p -62.71 -33.72 75.69 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.002 0.43 . . . . 0.7 110.654 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.6 mp -68.5 -44.25 75.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.169 -0.469 . . . . 1.33 110.401 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.84 -37.83 76.29 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.044 -0.526 . . . . 0.69 111.735 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.432 ' O ' ' HG2' ' A' ' 136' ' ' GLU . . . -64.44 -19.43 65.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.936 0.398 . . . . 0.84 111.426 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -85.14 -5.94 59.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.109 -0.496 . . . . 1.12 111.281 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.7 pp -132.13 19.09 4.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.857 0.361 . . . . 4.04 111.318 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 133' ' ' ALA . 4.4 pt-20 -81.45 -27.82 34.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.147 0.498 . . . . 6.64 110.175 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 20.8 t-80 . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.506 -0.759 . . . . 8.0 110.15 179.95 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 206' ' ' PRO . . . . . 0.496 ' HD2' ' OG ' ' A' ' 18' ' ' SER . 12.2 Cg_exo . . . . . 0 C--O 1.235 0.326 0 CA-C-O 120.722 0.218 . . . . 7.47 111.721 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 3.7 m 59.59 82.88 0.14 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.016 -0.538 . . . . 6.02 112.274 178.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 208' ' ' TYR . . . . . 0.4 ' CE1' ' HA ' ' B' ' 213' ' ' PRO . 89.8 t80 -78.8 130.1 35.34 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 122.226 -0.296 . . . . 4.07 110.34 179.259 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 209' ' ' SEP . . . . . 0.415 ' HA ' ' HD3' ' B' ' 210' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 210' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' B' ' 209' ' ' SEP . 33.1 Cg_exo -60.35 -27.32 84.64 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.536 2.157 . . . . 4.35 112.235 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.62 3.16 38.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.98 -0.555 . . . . 4.95 111.006 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 16.8 m -149.1 83.73 6.55 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 116.399 -0.364 . . . . 3.16 110.559 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 213' ' ' PRO . . . . . 0.4 ' HA ' ' CE1' ' B' ' 208' ' ' TYR . 43.5 Cg_endo -69.76 -12.48 32.99 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.469 2.113 . . . . 4.03 112.097 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.102 0 CA-C-N 115.615 -0.721 . . . . 5.57 110.319 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.877 0 CA-C-O 120.635 0.255 . . . . 5.47 110.586 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -113.46 -7.33 13.44 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.245 0.545 . . . . 5.34 110.362 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.2 m -79.15 79.23 5.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.915 -0.584 . . . . 2.73 111.085 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.44 ' O ' ' HG2' ' A' ' 6' ' ' GLU . 1.0 OUTLIER -71.58 108.22 4.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.926 -0.579 . . . . 3.24 110.454 179.692 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.493 ' HA ' ' SD ' ' A' ' 42' ' ' MET . 0.5 OUTLIER 36.12 50.4 0.7 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.182 0.993 . . . . 2.9 112.659 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.535 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 92.3 mm-40 -69.4 -17.37 63.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.056 -0.52 . . . . 2.75 110.644 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.521 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 78.5 t80 -79.93 -42.58 23.77 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.923 -0.581 . . . . 0.91 109.693 179.114 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.1 m -65.34 -34.54 78.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.65 -0.705 . . . . 0.86 111.494 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.07 -35.53 81.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.003 0.43 . . . . 1.42 110.719 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.535 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 31.1 mmmt -76.23 -38.81 55.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.056 -0.52 . . . . 1.3 110.584 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -60.97 -29.03 69.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.25 -0.432 . . . . 1.57 111.499 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 -83.76 -5.97 59.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.309 -0.405 . . . . 1.59 111.855 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.6 t -115.81 -3.27 12.23 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.669 -0.412 . . . . 1.63 111.44 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.408 HD21 ' HB2' ' A' ' 25' ' ' ALA . 32.5 mt -72.93 163.07 28.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.52 -0.309 . . . . 1.1 111.03 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -143.67 -170.26 3.26 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.708 -0.479 . . . . 2.16 109.708 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' B' ' 208' ' ' TYR . 1.1 t70 -76.67 -19.28 57.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.198 0.523 . . . . 1.94 110.379 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.521 ' HA ' ' CB ' ' B' ' 206' ' ' PRO . 0.0 OUTLIER -54.56 116.88 2.91 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.587 -0.733 . . . . 1.61 110.782 179.754 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.47 ' OE1' ' HA ' ' B' ' 208' ' ' TYR . 0.2 OUTLIER -55.47 -35.22 65.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.769 -0.651 . . . . 2.64 110.784 -179.485 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -65.7 -34.09 77.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.853 -0.612 . . . . 2.99 110.967 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.5 p -71.41 -40.11 70.69 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.575 -0.528 . . . . 1.1 109.575 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.1 mm -66.59 -44.18 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 CA-C-N 115.91 -0.587 . . . . 0.88 109.77 179.046 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 56.0 m -59.58 -38.01 80.02 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.971 -0.559 . . . . 1.18 111.173 179.464 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.3 m -67.9 -28.69 67.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.809 0.338 . . . . 1.16 110.832 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.408 ' HB2' HD21 ' A' ' 15' ' ' LEU . . . -82.78 -44.26 15.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.255 -0.43 . . . . 0.45 111.113 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.4 p -62.44 -44.01 97.45 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.726 0.298 . . . . 1.32 110.651 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -64.66 -36.96 85.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.982 0.42 . . . . 2.38 110.536 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -67.44 -36.16 80.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.267 0.556 . . . . 0.98 109.539 178.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -70.86 -39.41 72.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.715 -0.675 . . . . 1.3 110.559 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.0 mt -62.28 -24.91 67.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.303 -0.408 . . . . 1.06 110.739 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 24.0 mt -78.55 -16.38 57.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.99 -0.55 . . . . 1.71 111.338 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -120.58 46.5 1.98 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.075 0.464 . . . . 1.51 110.659 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -62.81 -9.69 10.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 1.61 111.386 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 77.5 mtt180 -66.28 -35.42 80.34 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.218 0.532 . . . . 3.97 110.088 178.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -103.79 27.63 7.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.617 -0.719 . . . . 1.7 110.86 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.478 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.51 -51.32 74.15 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.736 -0.665 . . . . 0.43 111.852 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.478 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 33.4 Cg_endo -64.5 -28.64 61.92 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 121.617 1.544 . . . . 0.5 112.089 179.499 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.1 tppt? -72.77 -46.27 54.27 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.023 -0.535 . . . . 2.78 111.185 -179.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 35.5 m -72.19 -25.23 23.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 C-N-CA 120.924 -0.311 . . . . 0.39 110.521 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.01 -49.2 62.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 0.32 110.494 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -68.91 -33.87 74.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.986 -0.552 . . . . 1.4 110.098 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.521 ' SD ' ' HB3' ' A' ' 8' ' ' PHE . 39.2 ttm -66.41 -40.05 89.34 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.935 -0.575 . . . . 1.51 109.916 179.123 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 51.5 t90 -62.48 -47.33 84.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.493 -0.776 . . . . 0.41 109.566 178.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 38.9 tttt -56.62 -47.71 79.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.384 -0.826 . . . . 1.11 110.802 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.579 ' O ' ' HG2' ' A' ' 49' ' ' ARG . 12.4 mm-40 -57.95 -44.68 87.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.044 -0.526 . . . . 1.96 111.304 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -66.18 -44.46 83.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 1.58 111.353 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 84.8 mmm -66.32 -29.62 69.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.303 -0.408 . . . . 0.7 111.577 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.2 mt -92.73 19.4 7.55 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.796 0.331 . . . . 0.88 111.365 -179.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.579 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 36.1 mmt-85 -87.08 133.88 38.04 Favored Pre-proline 0 C--N 1.328 -0.353 0 N-CA-C 110.011 -0.366 . . . . 2.69 110.011 178.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -74.34 -22.34 16.47 Favored 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.51 2.14 . . . . 0.94 112.397 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.3 m -83.3 -16.18 47.23 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.244 -0.435 . . . . 1.33 111.456 -179.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.6 t -77.76 127.36 38.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.122 0.486 . . . . 0.59 110.794 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -66.55 149.13 50.91 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.437 -0.801 . . . . 1.8 111.137 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.48 -39.46 70.43 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.097 0.406 . . . . 0.81 112.097 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 42.0 mtm105 -67.82 -29.73 68.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.877 0.37 . . . . 3.58 110.682 -179.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -69.3 -36.67 77.26 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.642 -0.503 . . . . 3.05 109.642 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 50.8 mttt -70.03 -33.15 71.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.695 -0.684 . . . . 0.59 109.291 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 19.9 tp -62.66 -41.01 98.83 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.667 -0.697 . . . . 1.26 109.811 178.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.9 mp -67.64 -36.99 81.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.468 -0.787 . . . . 1.54 109.997 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.17 -30.19 75.36 Favored Glycine 0 C--N 1.331 0.293 0 CA-C-N 115.802 -0.635 . . . . 0.37 111.604 179.212 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 8.3 mt -63.84 -44.63 92.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.882 0.372 . . . . 1.23 110.216 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -62.56 -39.22 92.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.672 -0.695 . . . . 1.38 110.548 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -61.25 -48.87 79.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.94 -0.573 . . . . 1.45 110.618 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.401 ' O ' HG12 ' A' ' 67' ' ' VAL . 14.7 tmm? -62.38 -48.56 79.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 0.61 110.295 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -58.5 -41.59 85.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.794 -0.639 . . . . 1.69 111.382 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -68.03 -47.72 67.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.157 -0.474 . . . . 1.54 111.612 -179.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.401 HG12 ' O ' ' A' ' 64' ' ' MET . 8.2 p -64.28 -36.29 76.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 112.645 0.609 . . . . 1.4 112.645 -177.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 64' ' ' MET . 35.7 m -78.27 -26.07 14.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 C-N-CA 120.726 -0.39 . . . . 0.43 111.28 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -52.07 20.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.018 0.437 . . . . 2.02 109.848 179.409 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 26.6 mm100 -72.27 -15.21 61.91 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.058 -0.519 . . . . 2.1 110.925 -179.626 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.79 -25.68 68.02 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.261 -0.427 . . . . 0.51 110.56 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.507 ' HG2' ' NE2' ' A' ' 80' ' ' GLN . 19.5 mtpt -70.63 -21.04 62.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.335 -0.393 . . . . 2.09 110.443 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.21 -43.69 31.44 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.967 -0.635 . . . . 0.66 112.177 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -91.47 -0.85 57.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.742 0.306 . . . . 1.62 110.616 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp 62.98 46.09 4.99 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.429 -0.805 . . . . 2.7 111.132 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 31.9 mm -95.89 78.7 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.921 -0.582 . . . . 0.63 110.124 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.571 ' HA ' ' OE1' ' A' ' 80' ' ' GLN . 15.4 pt -68.51 -16.3 20.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.713 -0.676 . . . . 0.86 110.295 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -61.48 -37.9 85.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.542 -0.754 . . . . 2.22 110.541 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.43 ' O ' ' HB2' ' A' ' 83' ' ' PHE . 0.8 OUTLIER -72.42 -42.13 65.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.017 -0.538 . . . . 1.34 111.173 -179.406 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.571 ' OE1' ' HA ' ' A' ' 77' ' ' ILE . 21.6 mt-30 -68.94 -27.47 65.77 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.081 -0.509 . . . . 1.3 111.511 -178.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.56 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 5.6 t70 -76.02 -49.21 18.23 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.97 0.415 . . . . 1.32 110.125 178.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.7 p -67.64 -49.15 64.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.022 -0.535 . . . . 0.94 111.516 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.43 ' HB2' ' O ' ' A' ' 79' ' ' PHE . 4.4 m-85 -71.36 -30.7 66.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.59 -0.277 . . . . 1.23 111.239 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.85 -52.03 54.93 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.107 -0.568 . . . . 0.34 113.785 -179.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.56 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 10.0 ptpt -60.26 -36.67 78.32 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.072 0.397 . . . . 1.31 112.072 -178.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.8 m -82.8 -28.01 8.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 C-N-CA 120.667 -0.413 . . . . 0.38 111.124 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 91' ' ' LEU . . . -62.14 -41.2 98.03 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.639 -0.255 . . . . 0.38 110.934 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.09 -33.9 69.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.028 0.442 . . . . 0.45 111.125 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -83.39 -52.46 6.51 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.909 -0.587 . . . . 1.56 110.873 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.508 ' O ' HG12 ' A' ' 94' ' ' ILE . 75.7 t -57.56 -50.83 75.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.093 -0.503 . . . . 0.34 111.997 -178.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.414 ' HB2' ' O ' ' A' ' 87' ' ' ALA . 8.5 mp -61.52 -38.52 87.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.692 -0.231 . . . . 1.45 111.087 -178.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -70.88 -28.82 70.02 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.506 -0.854 . . . . 0.41 112.005 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.535 ' O ' ' HG2' ' A' ' 96' ' ' GLN . 1.3 mmm-85 -78.02 -51.45 10.32 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.646 0.26 . . . . 3.46 111.063 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.508 HG12 ' O ' ' A' ' 90' ' ' VAL . 32.8 pt -70.78 -15.85 19.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.523 -0.308 . . . . 0.5 111.615 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -58.19 -34.16 70.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.018 0.437 . . . . 1.0 110.675 179.301 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.535 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 4.3 pt20 -96.56 1.74 51.64 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.155 -0.475 . . . . 1.14 110.799 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -100.67 -31.23 11.32 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.15 0.5 . . . . 1.33 109.965 179.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -81.67 131.76 56.82 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.518 -0.765 . . . . 1.39 111.11 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -65.1 167.6 15.8 Favored 'Trans proline' 0 CA--C 1.529 0.271 0 C-N-CA 122.699 2.266 . . . . 1.47 111.724 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 13.3 mmm180 -47.82 -40.57 21.51 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.852 0.686 . . . . 4.87 112.852 -179.067 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -71.53 -47.81 52.76 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.002 0.371 . . . . 2.58 112.002 -179.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 30.7 mt -70.94 -39.59 72.54 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.857 0.317 . . . . 0.85 111.857 -178.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LYS . . . . . 0.405 ' HB2' ' HE3' ' A' ' 103' ' ' LYS . 15.3 ptmt -71.15 -17.73 62.54 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.766 -0.374 . . . . 2.36 110.629 -179.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -67.22 -34.38 77.35 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.182 -1.044 . . . . 2.57 108.182 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.42 ' O ' HG23 ' A' ' 109' ' ' VAL . 74.0 mmtt -76.49 -37.05 57.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.178 -0.919 . . . . 2.44 109.064 178.359 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 35.4 tp -59.58 -37.58 78.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.549 -0.75 . . . . 1.27 109.974 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.556 ' O ' ' HB2' ' A' ' 111' ' ' ASN . 36.7 m -61.04 -37.48 82.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.619 -0.719 . . . . 1.15 110.328 179.259 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.9 mtt180 -70.24 -38.19 75.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 3.6 110.555 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.443 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 61.8 t -60.9 -57.2 13.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.039 -0.528 . . . . 1.25 110.719 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.445 ' HA ' HD12 ' A' ' 113' ' ' LEU . 10.8 p -65.18 -28.97 45.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.182 -0.463 . . . . 1.11 111.054 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.556 ' HB2' ' O ' ' A' ' 107' ' ' SER . 56.0 t30 -60.33 -55.71 30.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.248 -0.433 . . . . 1.74 110.307 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 95.7 mt -62.95 -36.19 74.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.092 -0.504 . . . . 1.21 111.154 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.445 HD12 ' HA ' ' A' ' 110' ' ' VAL . 71.5 mt -56.36 -42.8 78.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.363 -0.38 . . . . 1.33 111.764 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.78 -29.32 19.86 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.816 -0.353 . . . . 1.69 111.372 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -65.57 -38.55 89.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.764 0.316 . . . . 2.2 111.561 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 7.9 mmm180 -96.11 5.61 50.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.347 -0.388 . . . . 3.23 111.012 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.0 m120 52.22 57.75 6.13 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.391 0.615 . . . . 2.0 110.901 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 43.2 mm -76.13 -33.63 24.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.552 -0.749 . . . . 0.61 110.286 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' PHE . . . . . 0.432 ' HE2' HD13 ' A' ' 113' ' ' LEU . 80.5 m-85 -110.47 171.91 7.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.776 -0.647 . . . . 1.26 110.811 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.0 t -69.65 146.98 51.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.744 -0.662 . . . . 1.3 109.932 179.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 50.7 pttt -59.47 -27.48 66.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.759 0.281 . . . . 2.85 111.759 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -68.78 -44.23 74.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.842 0.353 . . . . 2.95 110.817 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.54 ' O ' HG13 ' A' ' 127' ' ' ILE . 9.1 p -82.47 -28.42 8.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.416 -0.356 . . . . 1.28 110.912 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 7.3 t -61.26 -43.22 96.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 109.633 -0.506 . . . . 1.23 109.633 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -64.7 -35.43 81.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.674 -0.694 . . . . 1.74 109.963 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -63.57 -41.26 98.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.872 -0.604 . . . . 1.44 110.219 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.54 HG13 ' O ' ' A' ' 123' ' ' VAL . 63.6 mt -62.73 -53.99 39.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.799 -0.637 . . . . 0.47 111.334 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -63.55 -36.54 84.12 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 120.994 -0.282 . . . . 2.05 111.08 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -61.98 -39.74 93.22 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.847 -0.427 . . . . 3.98 109.847 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 44.6 m -67.53 -39.77 85.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.916 -0.583 . . . . 0.7 110.493 179.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.0 mt -69.16 -29.45 67.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.094 -0.503 . . . . 1.33 110.927 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -78.78 -37.79 40.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.197 -0.456 . . . . 0.69 110.503 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.02 -19.26 62.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.829 -0.623 . . . . 0.84 111.782 -179.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.436 ' HB1' ' HG3' ' A' ' 136' ' ' GLU . . . -61.13 -44.87 96.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.432 -0.349 . . . . 1.12 111.072 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 68.9 mt 55.47 45.21 25.62 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.989 -0.55 . . . . 4.04 112.078 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.436 ' HG3' ' HB1' ' A' ' 134' ' ' ALA . 0.0 OUTLIER -106.21 3.19 27.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.045 0.45 . . . . 6.64 110.687 179.46 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.53 -0.747 . . . . 8.0 110.589 -179.605 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 206' ' ' PRO . . . . . 0.521 ' CB ' ' HA ' ' A' ' 18' ' ' SER . 2.8 Cg_exo . . . . . 0 CA--C 1.53 0.323 0 N-CA-C 111.634 -0.179 . . . . 7.47 111.634 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 3.2 m 59.64 81.1 0.18 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.189 0.519 . . . . 6.02 111.242 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 208' ' ' TYR . . . . . 0.47 ' HA ' ' OE1' ' A' ' 19' ' ' GLN . 3.4 t80 -65.27 113.4 4.0 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.973 -0.454 . . . . 4.07 110.471 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 209' ' ' SEP . . . . . 0.413 ' O3P' ' HD2' ' B' ' 210' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 210' ' ' PRO . . . . . 0.413 ' HD2' ' O3P' ' B' ' 209' ' ' SEP . 51.9 Cg_exo -54.59 -30.4 65.25 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.791 2.327 . . . . 4.35 112.757 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.17 -7.12 58.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.026 0.441 . . . . 4.95 110.977 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 9.0 m -139.5 72.55 37.01 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.523 -0.308 . . . . 3.16 110.522 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 213' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -76.21 -59.67 0.04 OUTLIER 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.887 2.392 . . . . 4.03 111.985 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.191 0 CA-C-O 118.56 -0.733 . . . . 5.57 110.136 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.963 0 CA-C-O 120.804 0.335 . . . . 5.47 110.724 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -102.78 162.56 12.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.351 -0.386 . . . . 5.34 110.428 179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -75.92 94.51 3.38 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.178 -0.465 . . . . 2.73 111.483 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -81.79 148.07 29.07 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.157 -0.474 . . . . 3.24 110.471 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.448 ' HG3' ' HB ' ' A' ' 9' ' ' THR . 0.0 OUTLIER 60.9 37.72 18.22 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 123.373 0.421 . . . . 2.9 111.693 179.186 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -56.46 -61.12 2.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.283 -0.417 . . . . 2.75 111.724 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -68.54 -42.56 78.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.05 0.452 . . . . 0.91 111.206 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.448 ' HB ' ' HG3' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -59.92 -42.49 94.04 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.964 0.727 . . . . 0.86 112.964 -178.57 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 6' ' ' GLU . 0.5 OUTLIER -72.11 -21.92 61.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.61 0.243 . . . . 1.42 111.385 -179.131 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -69.49 -36.74 76.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.74 0.305 . . . . 1.3 110.42 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -64.97 -28.88 69.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.236 0.541 . . . . 1.57 110.708 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -78.9 -10.59 59.86 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.673 -0.694 . . . . 1.59 110.919 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.59 36.28 4.64 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.171 0.51 . . . . 1.63 111.155 -179.529 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 15' ' ' LEU . 13.9 mt -112.36 163.2 14.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.051 0.453 . . . . 1.1 111.286 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -134.06 160.77 36.76 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.571 -0.74 . . . . 2.16 109.133 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -79.82 29.31 0.26 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.777 0.323 . . . . 1.94 111.701 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.585 ' OG ' ' HB3' ' B' ' 206' ' ' PRO . 68.6 m -93.32 140.95 28.99 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.179 -0.304 . . . . 1.61 110.179 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.641 ' OE1' ' HA ' ' B' ' 208' ' ' TYR . 0.4 OUTLIER -56.49 -52.86 63.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.121 -0.491 . . . . 2.64 110.333 -179.342 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -61.48 -40.77 95.76 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.908 -0.587 . . . . 2.99 111.775 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.535 ' OG ' ' HB2' ' A' ' 18' ' ' SER . 18.1 m -59.25 -49.1 79.13 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.765 0.316 . . . . 1.1 110.968 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.1 mm -64.1 -41.91 93.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.726 -0.472 . . . . 0.88 109.726 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.6 m -59.04 -40.88 86.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.928 -0.578 . . . . 1.18 111.01 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.3 m -61.26 -47.16 87.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 1.16 110.825 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.38 -42.0 79.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.347 -0.388 . . . . 0.45 111.052 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 19.1 m -62.7 -36.64 83.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.28 -0.418 . . . . 1.32 111.244 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.9 ttpt -61.24 -40.91 95.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.811 0.339 . . . . 2.38 110.532 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 33.1 t90 -68.59 -38.24 80.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.955 0.407 . . . . 0.98 109.916 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -64.12 -41.06 97.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.796 -0.638 . . . . 1.3 110.756 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.66 -33.24 73.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.119 -0.491 . . . . 1.06 110.732 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 74.8 mt -73.04 -25.18 60.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.968 -0.56 . . . . 1.71 110.308 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 70.9 mm-40 -97.93 48.42 1.01 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.044 -0.525 . . . . 1.51 110.613 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.452 ' HA ' ' CZ ' ' A' ' 79' ' ' PHE . 6.6 p90 -59.71 -21.31 60.44 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.681 -0.69 . . . . 1.61 111.614 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -75.64 -14.77 60.38 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.28 -0.418 . . . . 3.97 111.363 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -109.44 12.72 24.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.778 0.323 . . . . 1.7 110.899 -179.572 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.463 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -51.45 -51.02 73.17 Favored Pre-proline 0 CA--C 1.538 0.483 0 CA-C-N 115.903 -0.59 . . . . 0.43 112.414 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 39.3 Cg_endo -66.07 -19.92 57.19 Favored 'Trans proline' 0 C--N 1.357 0.978 0 C-N-CA 121.888 1.725 . . . . 0.5 112.831 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.7 tptm -88.28 -46.26 9.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.672 0.272 . . . . 2.78 110.821 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.2 m -67.44 -28.36 41.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.964 -0.294 . . . . 0.39 110.854 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.98 -46.77 80.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.362 -0.381 . . . . 0.32 111.337 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -70.41 -38.09 74.56 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.891 -0.324 . . . . 1.4 110.454 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 68.8 mtm -63.12 -41.91 99.42 Favored 'General case' 0 CA--C 1.521 -0.168 0 N-CA-C 109.98 -0.378 . . . . 1.51 109.98 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 71.1 t90 -61.95 -48.57 79.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.616 -0.72 . . . . 0.41 110.256 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.509 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 16.1 ttpt -58.71 -49.51 77.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.807 -0.633 . . . . 1.11 110.65 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.486 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 57.7 mm-40 -60.85 -42.3 97.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.886 -0.597 . . . . 1.96 111.087 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 76.3 t80 -62.65 -47.7 82.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.104 -0.498 . . . . 1.58 111.109 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 74.6 mmm -64.55 -20.8 66.45 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.26 -0.427 . . . . 0.7 111.988 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 64.0 mt -97.63 0.12 46.67 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.626 0.232 . . . . 0.88 111.626 -179.337 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.486 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 27.0 mtp180 -79.03 135.64 58.42 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.628 0.251 . . . . 2.69 110.528 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.12 5.95 3.28 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.909 2.406 . . . . 0.94 112.81 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.1 m -103.22 8.23 38.46 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.097 -0.501 . . . . 1.33 110.347 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.5 t -111.54 123.6 67.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.984 -0.553 . . . . 0.59 111.065 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -73.3 153.7 40.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.0 -0.545 . . . . 1.8 110.641 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.09 -32.56 62.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 0.81 112.193 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -42.37 98.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.875 0.369 . . . . 3.58 110.79 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.9 mtm-85 -71.57 -29.8 65.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.246 -0.434 . . . . 3.05 110.617 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 54.2 mttt -65.28 -34.43 78.33 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.334 -0.617 . . . . 0.59 109.334 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 21.4 tp -67.53 -41.25 84.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.803 -0.635 . . . . 1.26 109.315 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.7 mp -63.75 -44.83 92.32 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.291 -0.868 . . . . 1.54 110.032 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.16 -35.39 91.46 Favored Glycine 0 C--N 1.333 0.383 0 CA-C-N 115.845 -0.616 . . . . 0.37 111.949 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.36 -44.31 91.82 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.666 -0.494 . . . . 1.23 109.666 179.011 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -65.81 -34.47 78.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.801 -0.636 . . . . 1.38 111.114 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 39.3 tp -63.84 -44.14 94.07 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.76 -0.459 . . . . 1.45 109.76 178.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.449 ' O ' HG22 ' A' ' 68' ' ' VAL . 15.8 tmm? -64.97 -44.32 89.77 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.688 -0.687 . . . . 0.61 109.897 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -57.67 -39.7 77.68 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.817 -0.628 . . . . 1.69 110.999 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -67.04 -52.73 38.62 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.081 -0.509 . . . . 1.54 111.44 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 31.5 m -63.18 -34.89 69.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 112.817 0.673 . . . . 1.4 112.817 -178.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.449 HG22 ' O ' ' A' ' 64' ' ' MET . 34.6 m -78.5 -24.77 13.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 C-N-CA 120.276 -0.57 . . . . 0.43 110.969 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -76.74 -45.81 27.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.155 0.502 . . . . 2.02 109.953 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -75.29 -16.36 60.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.617 -0.719 . . . . 2.1 110.819 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.47 -33.99 73.38 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 116.06 -0.518 . . . . 0.51 110.682 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.555 ' HG2' HE22 ' A' ' 80' ' ' GLN . 1.8 mmtp -68.35 -27.32 66.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 2.09 110.347 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.01 -46.37 73.77 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.932 -0.576 . . . . 0.66 111.801 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -87.38 -6.56 58.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.981 0.42 . . . . 1.62 110.352 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.88 27.17 9.09 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.25 -0.886 . . . . 2.7 111.668 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.7 mm -94.44 87.71 2.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 109.343 -0.614 . . . . 0.63 109.343 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 18.2 pt -72.33 -8.8 12.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.901 -0.59 . . . . 0.86 111.796 -178.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -60.16 -33.38 72.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.918 0.389 . . . . 2.22 110.388 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.452 ' CZ ' ' HA ' ' A' ' 33' ' ' TYR . 29.7 m-85 -69.04 -48.72 62.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.873 -0.603 . . . . 1.34 109.615 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.555 HE22 ' HG2' ' A' ' 72' ' ' LYS . 86.0 mt-30 -65.19 -32.13 73.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.301 -0.863 . . . . 1.3 111.553 -179.066 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.501 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 9.5 t70 -72.74 -53.64 11.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.834 0.349 . . . . 1.32 110.406 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.4 m -63.65 -42.58 98.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.062 -0.517 . . . . 0.94 111.774 -179.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -78.35 -29.19 47.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.616 -0.265 . . . . 1.23 110.977 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -64.95 -41.65 97.26 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 121.049 -0.596 . . . . 0.34 113.346 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.501 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 12.8 ptpt -68.82 -18.34 64.15 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.042 0.386 . . . . 1.31 112.042 -178.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 32.6 m -107.95 -19.91 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 121.008 -0.277 . . . . 0.38 111.222 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.13 95.6 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.431 -0.35 . . . . 0.38 110.96 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.73 -44.2 73.33 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.077 -0.511 . . . . 0.45 110.624 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.411 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 35.4 tp10 -63.68 -58.72 6.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.601 -0.727 . . . . 1.56 110.208 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.485 ' O ' HG12 ' A' ' 94' ' ' ILE . 80.7 t -54.03 -50.27 55.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.761 -0.654 . . . . 0.34 111.994 -179.14 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 81.7 mt -60.97 -42.5 98.42 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.641 0.237 . . . . 1.45 111.641 -179.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -67.86 -25.02 74.33 Favored Glycine 0 CA--C 1.519 0.318 0 C-N-CA 120.718 -0.753 . . . . 0.41 112.241 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.411 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 33.5 mmm-85 -83.31 -55.05 4.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.641 0.258 . . . . 3.46 111.213 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.485 HG12 ' O ' ' A' ' 90' ' ' VAL . 30.6 pt -66.38 -19.8 26.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 112.359 0.503 . . . . 0.5 112.359 -178.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.1 t30 -63.45 -24.27 67.76 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.256 0.551 . . . . 1.0 110.31 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -90.74 -14.1 32.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.058 -0.519 . . . . 1.14 110.73 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -101.91 -28.69 12.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.03 -0.532 . . . . 1.33 111.048 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -70.26 121.76 84.21 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.166 -0.47 . . . . 1.39 111.411 -179.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -68.64 175.91 6.54 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.417 2.078 . . . . 1.47 111.822 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 13.5 ptt-85 -53.02 -27.67 20.53 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.052 -0.522 . . . . 4.87 112.106 -179.237 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -76.37 -48.42 19.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.028 0.442 . . . . 2.58 111.776 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 22.3 mt -76.7 -35.36 57.93 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.737 0.643 . . . . 0.85 112.737 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 6.0 pttp -64.89 -25.22 67.8 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.733 -0.387 . . . . 2.36 110.993 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' A' ' 100' ' ' ARG . 47.6 mtmt -66.31 -37.74 86.08 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.221 -0.659 . . . . 2.57 109.221 178.1 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -75.68 -34.26 60.42 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.162 -0.926 . . . . 2.44 109.798 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 7.0 tt -63.79 -41.99 97.82 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.417 -0.81 . . . . 1.27 109.985 178.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 21.0 m -62.58 -32.5 73.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.126 -0.488 . . . . 1.15 110.611 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 70.6 mtt180 -67.17 -55.43 14.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.028 -0.533 . . . . 3.6 111.286 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 7.7 p -62.48 -42.5 95.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.307 -0.406 . . . . 1.25 111.983 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.72 -40.56 82.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 120.836 0.35 . . . . 1.11 110.555 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.458 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 11.9 t-20 -61.28 -48.56 80.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.867 -0.606 . . . . 1.74 110.637 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 63.3 mt -61.12 -46.71 96.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.281 -0.418 . . . . 1.21 111.347 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 96.3 mt -59.12 -42.49 90.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.094 -0.503 . . . . 1.33 112.291 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 111' ' ' ASN . 1.2 ptpt -78.48 -33.31 48.31 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.054 0.39 . . . . 1.69 112.054 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -75.62 -39.2 58.19 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.906 0.336 . . . . 2.2 111.906 -178.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -79.96 -1.15 38.24 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.033 0.444 . . . . 3.23 110.801 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 60.8 50.76 5.18 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.589 -0.732 . . . . 2.0 111.454 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 45.9 mm -72.47 -40.6 63.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.091 0.472 . . . . 0.61 110.235 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -109.52 173.85 6.13 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.938 -0.574 . . . . 1.26 109.835 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.78 162.69 29.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.175 -0.466 . . . . 1.3 110.863 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 15.2 mmmt -52.74 -50.27 63.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.17 -0.468 . . . . 2.85 111.292 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -56.37 -34.45 66.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.843 -0.617 . . . . 2.95 112.072 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 61.6 t -80.14 -49.58 18.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.793 0.294 . . . . 1.28 111.793 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 34.7 m -62.63 -29.74 47.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 C-N-CA 120.964 -0.294 . . . . 1.23 111.159 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -78.92 -27.16 43.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.931 0.395 . . . . 1.74 110.819 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.48 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 44.8 t0 -76.63 -41.25 46.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.267 0.556 . . . . 1.44 109.959 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 96.3 mt -60.08 -50.97 78.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.826 -0.624 . . . . 0.47 111.42 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -65.65 -37.39 86.41 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.123 0.416 . . . . 2.05 112.123 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.48 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 33.2 ptt180 -69.63 -26.03 64.22 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 120.761 -0.376 . . . . 3.98 110.785 -179.506 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 49.3 m -68.36 -39.18 81.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.294 0.568 . . . . 0.7 109.684 178.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.8 mp -67.39 -41.93 84.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.735 -0.666 . . . . 1.33 110.123 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.06 -34.9 77.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.795 -0.638 . . . . 0.69 111.043 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -73.14 -25.08 60.69 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.825 0.345 . . . . 0.84 111.086 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -78.32 -23.44 47.04 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.513 -0.312 . . . . 1.12 110.992 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 54.3 mt 58.07 31.8 21.16 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.778 -0.646 . . . . 4.04 111.124 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -95.49 7.05 47.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.339 0.59 . . . . 6.64 110.682 -179.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.587 -0.721 . . . . 8.0 110.065 -179.773 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 206' ' ' PRO . . . . . 0.585 ' HB3' ' OG ' ' A' ' 18' ' ' SER . 3.8 Cg_exo . . . . . 0 N--CA 1.476 0.488 0 N-CA-C 111.201 -0.346 . . . . 7.47 111.201 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 18.4 m 59.5 83.26 0.13 Allowed 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.489 0.661 . . . . 6.02 111.78 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 208' ' ' TYR . . . . . 0.641 ' HA ' ' OE1' ' A' ' 19' ' ' GLN . 7.4 t80 -71.89 133.08 45.21 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.681 -0.69 . . . . 4.07 110.196 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 209' ' ' SEP . . . . . 0.507 ' HB2' ' OG ' ' B' ' 212' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -55.91 -32.89 87.12 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.988 2.459 . . . . 4.35 114.012 -178.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -88.15 0.36 56.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.921 0.391 . . . . 4.95 111.35 -179.102 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 212' ' ' SER . . . . . 0.507 ' OG ' ' HB2' ' B' ' 209' ' ' SEP . 0.1 OUTLIER -140.29 79.89 20.5 Favored Pre-proline 0 C--O 1.235 0.34 0 CA-C-N 116.39 -0.368 . . . . 3.16 110.252 179.292 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 213' ' ' PRO . . . . . 0.453 ' HA ' ' CZ ' ' B' ' 208' ' ' TYR . 73.3 Cg_endo -75.49 -30.7 6.24 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.836 2.357 . . . . 4.03 112.955 -179.467 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 8.9 m . . . . . 0 C--O 1.248 0.991 0 CA-C-O 117.781 -1.104 . . . . 5.57 109.041 -179.789 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 120.719 0.295 . . . . 5.47 110.681 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -121.29 151.16 40.37 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.864 -0.421 . . . . 5.34 109.864 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.0 m -64.53 111.41 2.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.037 0.446 . . . . 2.73 110.602 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 m -88.28 135.78 33.29 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.912 -0.586 . . . . 3.24 111.536 -179.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 53.07 58.36 5.39 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.39 -0.823 . . . . 2.9 112.248 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.587 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 48.8 mt-30 -65.76 -34.73 78.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.746 -0.661 . . . . 2.75 110.08 179.226 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.574 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 70.3 t80 -59.11 -48.97 79.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.73 -0.668 . . . . 0.91 110.508 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.0 -39.08 88.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.889 -0.596 . . . . 0.86 111.039 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -64.99 -32.49 74.24 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 115.889 -0.596 . . . . 1.42 111.197 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 27.6 mmmt -76.49 -40.72 49.45 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 121.065 -0.254 . . . . 1.3 110.589 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.15 -39.78 91.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.067 -0.515 . . . . 1.57 111.381 -179.38 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -76.11 -1.96 28.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.425 -0.352 . . . . 1.59 111.599 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.7 m -126.93 32.39 5.12 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.586 0.708 . . . . 1.63 110.155 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 15' ' ' LEU . 14.6 mt -111.75 168.1 9.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.683 -0.69 . . . . 1.1 111.162 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.541 ' HG2' ' H ' ' A' ' 17' ' ' ASP . 11.1 tt0 -137.9 173.72 11.33 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.551 -0.907 . . . . 2.16 108.551 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.541 ' H ' ' HG2' ' A' ' 16' ' ' GLU . 4.6 p30 -79.78 16.43 1.14 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.768 0.318 . . . . 1.94 111.665 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.413 ' O ' HG12 ' A' ' 22' ' ' ILE . 0.0 OUTLIER -82.07 132.67 35.25 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.832 -0.433 . . . . 1.61 109.832 178.885 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.45 ' HG2' ' N ' ' A' ' 20' ' ' GLU . 16.5 pm0 -62.94 -39.21 93.93 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.019 0.377 . . . . 2.64 112.019 -178.33 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.45 ' N ' ' HG2' ' A' ' 19' ' ' GLN . 5.9 tp10 -71.31 -25.62 62.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.995 0.426 . . . . 2.99 110.152 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 66.8 m -71.21 -44.32 65.63 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.9 -0.778 . . . . 1.1 108.9 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 18' ' ' SER . 47.2 mm -65.29 -45.09 94.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 108.69 -0.856 . . . . 0.88 108.69 178.3 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.8 t -54.86 -43.81 73.42 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.208 -0.905 . . . . 1.18 110.884 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.8 t -58.45 -43.51 88.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 1.16 110.857 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.9 -45.15 59.78 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.266 -0.424 . . . . 0.45 110.989 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 34.4 m -59.8 -40.65 89.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.325 -0.398 . . . . 1.32 111.306 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.57 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 8.2 mptt -56.97 -43.97 82.15 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.085 0.469 . . . . 2.38 110.273 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 24.2 t90 -68.93 -36.68 78.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.674 -0.694 . . . . 0.98 110.454 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -66.85 -43.64 83.1 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.193 -0.458 . . . . 1.3 110.91 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.4 mt -60.3 -27.41 67.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.071 -0.513 . . . . 1.06 111.793 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 77.8 mt -68.37 -39.09 81.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.934 0.397 . . . . 1.71 111.109 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.423 ' H ' ' HG2' ' A' ' 32' ' ' GLN . 9.5 pt20 -95.28 56.77 1.92 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.454 0.645 . . . . 1.51 110.716 -179.617 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.408 ' HA ' ' CE2' ' A' ' 79' ' ' PHE . 36.5 p90 -64.51 -17.24 63.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.476 -0.784 . . . . 1.61 111.557 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 34' ' ' ARG . 9.3 ttp180 -79.9 -3.7 49.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.831 0.348 . . . . 3.97 111.229 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.45 22.18 12.23 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.073 0.463 . . . . 1.7 110.05 179.301 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.459 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.05 -51.75 68.39 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.253 -0.885 . . . . 0.43 112.274 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.46 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 24.1 Cg_endo -62.77 -33.06 77.58 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 121.721 1.614 . . . . 0.5 112.521 179.307 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -46.73 72.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.334 -0.394 . . . . 2.78 111.059 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.2 m -74.56 -25.72 19.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.684 -0.406 . . . . 0.39 110.728 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.05 -49.99 65.74 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.359 -0.382 . . . . 0.32 110.769 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 4.1 pt-20 -66.71 -35.94 81.31 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.328 -0.396 . . . . 1.4 110.258 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.574 ' SD ' ' HB3' ' A' ' 8' ' ' PHE . 16.3 ttm -65.18 -40.67 94.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.095 -0.502 . . . . 1.51 109.946 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 67.4 t90 -63.78 -48.03 78.53 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.793 -0.64 . . . . 0.41 109.645 178.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.8 ttpt -59.75 -46.89 87.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.785 -0.643 . . . . 1.11 110.396 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.548 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 0.8 OUTLIER -59.72 -47.14 86.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.989 -0.55 . . . . 1.96 110.526 179.798 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -61.37 -49.64 76.11 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.714 -0.675 . . . . 1.58 111.549 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 89.0 mmm -63.4 -28.38 69.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.376 -0.374 . . . . 0.7 111.937 -179.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 73.6 mt -97.89 22.48 9.2 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 111.648 0.24 . . . . 0.88 111.648 -179.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 11.2 mtp180 -101.18 139.22 20.28 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.722 0.296 . . . . 2.69 110.689 179.185 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.26 -1.81 11.47 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 123.128 2.552 . . . . 0.94 112.789 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.15 17.34 21.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.998 -0.546 . . . . 1.33 110.751 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 24.2 t -123.32 114.8 43.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.082 -0.508 . . . . 0.59 111.15 -179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -67.23 159.65 28.66 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.93 -0.577 . . . . 1.8 110.02 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.35 -37.9 73.3 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.54 0.57 . . . . 0.81 112.54 -178.799 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -40.94 95.53 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.604 0.24 . . . . 3.58 110.613 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.1 mtm-85 -70.56 -36.46 73.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.407 -0.36 . . . . 3.05 110.465 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -65.37 -37.37 86.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.419 0.628 . . . . 0.59 109.369 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 19.2 tp -64.08 -36.81 85.23 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.585 -0.734 . . . . 1.26 109.595 178.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.3 mp -68.21 -39.37 82.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.41 -0.814 . . . . 1.54 109.819 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.29 -32.95 85.9 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 111.452 -0.659 . . . . 0.37 111.452 179.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.431 HD21 HD21 ' A' ' 91' ' ' LEU . 0.4 OUTLIER -67.24 -40.19 86.29 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.431 -0.581 . . . . 1.23 109.431 178.643 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -60.35 -44.57 95.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.555 -0.748 . . . . 1.38 110.264 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 12.4 tp -63.25 -43.9 96.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.004 -0.544 . . . . 1.45 110.701 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.439 ' O ' HG22 ' A' ' 68' ' ' VAL . 12.7 tmm? -59.86 -49.62 76.98 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.006 -0.543 . . . . 0.61 110.392 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -59.25 -42.69 91.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.062 0.458 . . . . 1.69 110.325 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 40.5 t-80 -61.99 -53.82 50.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.708 -0.678 . . . . 1.54 112.1 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 35.8 m -62.05 -37.45 78.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 N-CA-C 112.89 0.7 . . . . 1.4 112.89 -177.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.439 HG22 ' O ' ' A' ' 64' ' ' MET . 33.0 m -79.06 -27.04 13.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 120.368 -0.533 . . . . 0.43 111.44 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -72.12 -49.06 39.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.995 0.426 . . . . 2.02 109.854 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -71.44 -20.21 62.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.805 -0.634 . . . . 2.1 110.614 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.1 -21.54 66.57 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.052 -0.522 . . . . 0.51 111.201 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.87 -31.47 69.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.775 0.322 . . . . 2.09 110.298 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -75.89 -40.78 29.8 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.632 -0.794 . . . . 0.66 111.232 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -79.52 -12.63 59.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.71 -0.245 . . . . 1.62 110.555 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 41.1 mttp 65.27 34.07 8.67 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 123.658 0.599 . . . . 2.7 110.93 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 27.0 mm -93.06 85.55 2.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.043 -0.526 . . . . 0.63 110.264 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 19.5 pt -69.95 -24.89 26.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.761 -0.654 . . . . 0.86 110.999 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.83 -35.47 74.81 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.104 -0.498 . . . . 2.22 110.713 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.408 ' CE2' ' HA ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -69.75 -49.13 56.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.249 -0.432 . . . . 1.34 110.333 179.633 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -63.31 -35.64 81.04 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.482 -0.781 . . . . 1.3 111.027 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.547 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 17.3 t70 -66.53 -51.11 60.19 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.081 0.467 . . . . 1.32 110.544 179.239 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.8 m -63.24 -42.28 99.2 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.447 -0.797 . . . . 0.94 111.84 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -77.87 -35.09 51.32 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.965 -0.294 . . . . 1.23 111.334 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.84 -40.89 98.87 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 121.393 -0.432 . . . . 0.34 113.845 -178.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.547 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 14.3 ptpt -65.98 -24.27 66.75 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 117.148 0.474 . . . . 1.31 112.234 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.2 m -105.1 -15.13 8.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 C-N-CA 120.914 -0.314 . . . . 0.38 111.022 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.73 -49.99 74.21 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.193 -0.458 . . . . 0.38 111.215 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.1 -41.61 75.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.496 . . . . 0.45 111.04 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.555 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 4.8 tp10 -62.62 -60.07 4.03 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.753 -0.658 . . . . 1.56 110.449 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.512 ' O ' HG12 ' A' ' 94' ' ' ILE . 72.6 t -56.45 -49.22 78.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.728 -0.669 . . . . 0.34 111.835 -178.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.431 HD21 HD21 ' A' ' 61' ' ' LEU . 54.4 mt -58.63 -38.32 77.82 Favored 'General case' 0 C--N 1.331 -0.22 0 O-C-N 123.146 0.279 . . . . 1.45 111.532 -179.146 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -70.6 -28.89 70.3 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.703 -0.761 . . . . 0.41 112.72 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.555 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 23.9 mmm-85 -83.44 -49.62 9.12 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 122.857 -0.202 . . . . 3.46 111.3 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.512 HG12 ' O ' ' A' ' 90' ' ' VAL . 20.8 pt -66.09 -20.37 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 N-CA-C 111.988 0.366 . . . . 0.5 111.988 -178.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.42 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 51.8 t30 -63.1 -28.16 69.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.333 0.587 . . . . 1.0 109.937 179.076 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -88.67 -13.21 40.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.724 -0.671 . . . . 1.14 110.738 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -97.1 -38.03 9.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.968 -0.56 . . . . 1.33 111.147 -179.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 14.0 m-30 -72.8 125.94 90.9 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 116.424 -0.353 . . . . 1.39 110.932 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.48 177.44 3.96 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.554 2.169 . . . . 1.47 112.029 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 13.8 ptt-85 -52.61 -36.05 55.57 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 112.862 0.69 . . . . 4.87 112.862 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.481 ' HA ' ' HE2' ' A' ' 104' ' ' LYS . 1.3 m-20 -76.66 -25.28 53.55 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.741 0.645 . . . . 2.58 112.741 -178.359 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 14.9 mt -93.37 -31.18 14.75 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.868 -0.333 . . . . 0.85 110.972 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LYS . . . . . 0.523 ' HA ' HD23 ' A' ' 106' ' ' LEU . 32.0 pttt -63.14 -31.61 72.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.456 -0.338 . . . . 2.36 111.134 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.481 ' HE2' ' HA ' ' A' ' 101' ' ' ASP . 51.3 mtmt -64.43 -37.92 89.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.053 0.454 . . . . 2.57 110.302 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.6 mttm -70.46 -40.97 73.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.843 -0.617 . . . . 2.44 109.852 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.523 HD23 ' HA ' ' A' ' 103' ' ' LYS . 0.1 OUTLIER -65.31 -35.91 82.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.955 -0.566 . . . . 1.27 109.728 178.877 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 65.1 m -62.89 -37.18 85.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.185 -0.461 . . . . 1.15 110.362 178.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 39.1 mtt180 -65.05 -36.52 84.6 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 109.847 -0.427 . . . . 3.6 109.847 179.161 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 49.1 t -67.37 -49.76 68.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.991 -0.55 . . . . 1.25 110.013 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 71.0 t -59.16 -37.1 66.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.208 0.527 . . . . 1.11 110.043 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -60.12 -59.61 5.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.342 -0.844 . . . . 1.74 111.06 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.7 tt -61.41 -34.31 60.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 N-CA-C 111.847 0.314 . . . . 1.21 111.847 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 73.6 mt -63.09 -49.98 72.32 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.931 0.345 . . . . 1.33 111.931 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.6 ptpt -82.56 -29.1 30.54 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.07 0.396 . . . . 1.69 112.07 -178.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -67.18 -41.9 85.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.715 0.293 . . . . 2.2 110.908 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -90.8 3.69 53.72 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.529 -0.305 . . . . 3.23 110.523 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 51.27 59.28 4.71 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.618 -0.719 . . . . 2.0 111.059 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 46.6 mm -73.89 -38.75 50.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.677 -0.692 . . . . 0.61 109.888 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -107.15 169.52 8.51 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.691 -0.686 . . . . 1.26 109.569 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.52 157.67 19.83 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 123.27 0.356 . . . . 1.3 110.517 179.285 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.405 ' HA ' HG22 ' A' ' 124' ' ' VAL . 0.0 OUTLIER -57.25 -35.39 69.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.506 -0.315 . . . . 2.85 111.429 -178.963 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -68.11 -37.01 80.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.826 0.346 . . . . 2.95 110.764 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 58.5 t -70.46 -47.11 67.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.326 -0.397 . . . . 1.28 110.88 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.405 HG22 ' HA ' ' A' ' 121' ' ' LYS . 27.5 m -66.21 -24.31 33.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.982 0.42 . . . . 1.23 110.43 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.27 -20.57 47.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.879 -0.601 . . . . 1.74 110.241 179.031 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.504 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 20.3 t0 -83.87 -39.57 19.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.421 0.629 . . . . 1.44 109.721 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 63.1 mt -61.93 -46.5 96.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.701 -0.681 . . . . 0.47 110.91 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -66.36 -37.85 86.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.431 -0.35 . . . . 2.05 111.764 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 30.5 ptt180 -68.93 -39.57 79.53 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.84 -0.344 . . . . 3.98 110.741 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 48.7 m -70.24 -35.37 73.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.948 0.404 . . . . 0.7 110.794 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.9 -45.6 81.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.181 -0.463 . . . . 1.33 110.266 179.269 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.83 -39.15 69.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.726 -0.67 . . . . 0.69 111.535 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.27 -31.68 72.3 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.82 0.343 . . . . 0.84 111.498 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.6 -19.56 65.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.098 -0.501 . . . . 1.12 111.589 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 95.3 mt 58.0 32.06 21.47 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.282 0.563 . . . . 4.04 111.095 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 95' ' ' ASN . 8.3 tp10 -99.29 1.21 44.4 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.954 -0.566 . . . . 6.64 110.75 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 . . . . . 0 C--O 1.244 0.771 0 CA-C-O 118.623 -0.704 . . . . 8.0 109.341 -179.986 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 206' ' ' PRO . . . . . 0.407 ' HB2' ' HA ' ' A' ' 18' ' ' SER . 18.7 Cg_exo . . . . . 0 N--CA 1.473 0.288 0 N-CA-C 111.657 -0.17 . . . . 7.47 111.657 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 50.1 m 70.0 74.58 0.22 Allowed 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 121.54 0.686 . . . . 6.02 112.575 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -65.37 133.06 50.56 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.861 -0.609 . . . . 4.07 110.507 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 209' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -52.25 -30.99 44.33 Favored 'Trans proline' 0 N--CA 1.476 0.443 0 C-N-CA 122.8 2.333 . . . . 4.35 113.432 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.56 8.82 23.36 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.918 0.389 . . . . 4.95 111.713 -179.562 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.52 74.24 47.22 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.643 -0.253 . . . . 3.16 110.349 179.318 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 213' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -64.37 -55.71 0.54 Allowed 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.47 2.113 . . . . 4.03 112.374 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.227 0 CA-C-O 118.254 -0.879 . . . . 5.57 109.359 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.942 0 CA-C-O 121.068 0.461 . . . . 5.47 110.657 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -123.7 124.7 43.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.379 -0.373 . . . . 5.34 110.393 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.2 m -105.16 124.58 49.77 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.712 -0.477 . . . . 2.73 109.712 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 m -84.89 -42.86 14.62 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.855 0.359 . . . . 3.24 111.403 -179.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -88.91 33.74 0.78 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.13 0.49 . . . . 2.9 111.301 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -65.25 -31.89 73.27 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.745 -0.661 . . . . 2.75 110.874 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -91.37 -38.05 12.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.961 -0.563 . . . . 0.91 110.634 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.84 -44.26 94.16 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.731 -0.668 . . . . 0.86 112.487 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 4.5 t -68.33 -26.85 65.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.645 0.259 . . . . 1.42 111.236 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.516 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 29.8 mmmt -68.8 -36.15 77.9 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 120.805 0.336 . . . . 1.3 110.146 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 42.9 mt -67.54 -34.84 77.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.913 -0.585 . . . . 1.57 110.669 179.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 -70.12 -31.28 68.74 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.75 -0.659 . . . . 1.59 111.621 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.5 t -104.09 16.52 26.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.751 0.31 . . . . 1.63 111.81 -179.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 8.1 mt -73.73 176.4 6.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.101 0.477 . . . . 1.1 111.342 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.46 ' HG2' ' H ' ' A' ' 17' ' ' ASP . 5.6 tt0 -146.25 168.8 20.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.715 -0.675 . . . . 2.16 109.552 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.46 ' H ' ' HG2' ' A' ' 16' ' ' GLU . 5.2 p-10 -84.16 10.26 10.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.193 0.521 . . . . 1.94 110.089 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.471 ' O ' HG12 ' A' ' 22' ' ' ILE . 1.4 t -77.16 129.04 35.45 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.509 -0.769 . . . . 1.61 110.53 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.59 ' OE1' ' HA ' ' B' ' 208' ' ' TYR . 3.2 mt-30 -65.34 -33.2 75.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.494 0.664 . . . . 2.64 109.841 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -66.93 -46.43 74.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.986 -1.006 . . . . 2.99 111.096 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.6 p -69.14 -39.48 78.83 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 121.071 -0.252 . . . . 1.1 111.46 -179.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 18' ' ' SER . 39.7 mm -59.25 -45.24 93.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 120.765 0.317 . . . . 0.88 110.383 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 t -63.97 -29.91 71.03 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.175 -0.466 . . . . 1.18 110.531 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.0 m -68.62 -31.12 70.06 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.134 -0.485 . . . . 1.16 110.399 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.15 -44.88 28.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.921 -0.582 . . . . 0.45 110.681 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.7 p -64.96 -33.18 75.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.313 -0.403 . . . . 1.32 110.673 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.438 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -63.1 -33.15 74.83 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.256 -0.429 . . . . 2.38 110.734 179.374 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 17.4 t90 -79.87 -34.51 39.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.05 0.452 . . . . 0.98 109.946 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.1 mp -63.78 -41.23 97.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.989 -0.55 . . . . 1.3 110.923 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.59 -21.08 66.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.459 -0.337 . . . . 1.06 111.803 -179.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 79.1 mt -76.24 -32.23 58.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.837 0.351 . . . . 1.71 110.634 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -105.19 59.8 0.68 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.671 0.748 . . . . 1.51 109.791 179.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 28.1 p90 -60.85 -21.34 63.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.137 -0.938 . . . . 1.61 111.831 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 66.7 mtt180 -77.86 -12.35 59.97 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.075 0.464 . . . . 3.97 110.506 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.34 7.09 44.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.044 -0.525 . . . . 1.7 110.492 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.466 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -51.31 -52.57 58.02 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-N 115.518 -0.765 . . . . 0.43 112.316 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 21.7 Cg_endo -61.76 -31.71 85.93 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 121.853 1.702 . . . . 0.5 112.227 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 42' ' ' MET . 47.3 mtpt -73.17 -51.08 19.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.942 -0.572 . . . . 2.78 111.174 -179.205 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 28.0 m -67.96 -27.07 36.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 120.998 -0.281 . . . . 0.39 110.931 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.32 -51.44 60.61 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.934 0.397 . . . . 0.32 110.527 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -70.06 -34.94 73.84 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.382 -0.372 . . . . 1.4 110.12 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.429 ' HB2' ' O ' ' A' ' 38' ' ' LYS . 14.4 ttm -61.96 -42.22 98.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.972 -0.558 . . . . 1.51 109.655 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 53.4 t90 -63.35 -49.95 71.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.228 -0.896 . . . . 0.41 110.191 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.512 ' HE2' HD12 ' A' ' 48' ' ' LEU . 11.9 tmtt? -58.16 -46.51 85.58 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.764 -0.653 . . . . 1.11 110.949 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.506 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 64.7 mm-40 -61.54 -47.35 85.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.029 -0.532 . . . . 1.96 111.7 -179.506 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -65.39 -45.7 82.95 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.177 -0.465 . . . . 1.58 111.152 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 72.9 mmm -63.4 -28.39 69.95 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.196 0.443 . . . . 0.7 112.196 -178.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.512 HD12 ' HE2' ' A' ' 44' ' ' LYS . 15.4 mt -97.26 14.99 24.1 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 111.927 0.343 . . . . 0.88 111.927 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.506 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 79.5 mtt180 -89.29 139.76 28.56 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 110.301 -0.259 . . . . 2.69 110.301 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.08 -18.32 27.49 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.942 2.428 . . . . 0.94 112.685 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.23 -7.15 56.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.211 0.529 . . . . 1.33 111.252 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.2 t -97.81 125.27 51.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.034 -0.53 . . . . 0.59 110.853 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -74.49 152.71 39.36 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.695 -0.684 . . . . 1.8 110.015 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -34.64 64.07 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.12 0.415 . . . . 0.81 112.12 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.59 -34.47 78.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.845 0.355 . . . . 3.58 110.671 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.4 mmt-85 -74.4 -33.47 63.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.381 -0.372 . . . . 3.05 110.299 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 57.4 mttt -65.44 -32.28 73.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.08 -0.509 . . . . 0.59 109.956 179.483 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 75.3 mt -63.94 -43.13 96.8 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.397 -0.594 . . . . 1.26 109.397 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.5 mp -64.78 -41.53 95.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.395 -0.82 . . . . 1.54 110.068 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.31 -36.6 93.41 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.884 -0.674 . . . . 0.37 111.458 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 49.1 tp -69.79 -36.14 75.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.998 0.428 . . . . 1.23 110.065 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 9.8 m-30 -61.59 -40.11 93.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.706 -0.679 . . . . 1.38 110.648 179.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.75 -40.78 98.32 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.917 -0.583 . . . . 1.45 110.539 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.485 ' O ' HG22 ' A' ' 68' ' ' VAL . 13.4 tmm? -61.5 -51.39 68.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.357 -0.383 . . . . 0.61 110.441 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.444 ' O ' ' HB2' ' A' ' 69' ' ' GLN . 13.5 t30 -58.92 -35.91 73.85 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.968 0.413 . . . . 1.69 111.086 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.469 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 1.9 t-80 -74.84 -50.42 17.14 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.302 -0.408 . . . . 1.54 111.804 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 9.9 p -60.18 -39.28 80.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 112.092 0.404 . . . . 1.4 112.092 -178.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.485 HG22 ' O ' ' A' ' 64' ' ' MET . 33.6 m -75.01 -24.18 17.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 120.769 -0.372 . . . . 0.43 111.03 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.444 ' HB2' ' O ' ' A' ' 65' ' ' ASN . 3.0 tp-100 -67.91 -49.53 61.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.111 0.481 . . . . 2.02 110.151 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 6.7 pt20 -82.89 -14.95 53.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.793 -0.64 . . . . 2.1 111.202 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.64 -38.67 91.79 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 120.994 0.426 . . . . 0.51 110.191 179.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -68.76 -25.65 64.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.66 -0.7 . . . . 2.09 110.383 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.19 -31.06 79.44 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 111.067 -0.813 . . . . 0.66 111.067 178.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -99.02 -3.19 35.42 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.205 -0.665 . . . . 1.62 109.205 178.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.0 mttp 57.84 40.09 26.32 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 114.696 -1.138 . . . . 2.7 112.05 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 24.3 mm -90.99 90.8 3.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.585 -0.524 . . . . 0.63 109.585 179.295 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 18.5 pt -66.85 -14.19 17.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.863 -0.608 . . . . 0.86 111.689 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -58.48 -44.16 89.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.876 0.369 . . . . 2.22 110.254 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -70.96 -37.33 72.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.129 -0.487 . . . . 1.34 110.444 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -62.12 -37.42 85.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.911 -0.586 . . . . 1.3 110.851 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -80.26 -46.81 15.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.535 -0.302 . . . . 1.32 110.677 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.557 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 66.1 m -57.65 -52.1 66.82 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.057 -0.52 . . . . 0.94 111.786 -179.525 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -82.44 -21.01 35.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.547 -0.297 . . . . 1.23 111.485 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -64.4 -51.3 53.67 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.861 -0.685 . . . . 0.34 113.491 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.557 ' HE2' ' HA ' ' A' ' 82' ' ' SER . 25.9 pttt -68.15 -12.77 61.49 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.776 0.658 . . . . 1.31 112.776 -178.343 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 33.1 m -109.35 -16.03 9.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 120.719 -0.392 . . . . 0.38 111.417 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.14 87.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.358 -0.383 . . . . 0.38 111.1 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.86 -38.82 83.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.056 -0.52 . . . . 0.45 110.95 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -63.84 -52.91 57.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.745 -0.662 . . . . 1.56 110.614 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.53 ' O ' HG12 ' A' ' 94' ' ' ILE . 99.6 t -65.38 -45.2 93.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.822 -0.627 . . . . 0.34 111.265 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -58.49 -45.09 89.43 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.732 0.301 . . . . 1.45 111.268 -179.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -68.17 -26.06 74.27 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.729 -0.748 . . . . 0.41 112.505 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 4.8 mmm-85 -85.54 -46.97 10.33 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.862 0.319 . . . . 3.46 111.862 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 90' ' ' VAL . 43.1 pt -65.84 -26.86 39.67 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 C-N-CA 121.119 -0.232 . . . . 0.5 111.371 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 60.7 t30 -62.27 -26.74 68.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.062 0.458 . . . . 1.0 110.493 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -81.67 -35.59 29.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.065 -0.516 . . . . 1.14 110.422 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -81.34 -30.04 33.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.834 -0.621 . . . . 1.33 111.396 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.411 ' HA ' ' HD3' ' A' ' 99' ' ' PRO . 8.2 m-30 -81.37 118.54 72.7 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 116.043 -0.526 . . . . 1.39 111.613 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 98' ' ' PHE . 25.8 Cg_exo -64.35 -177.41 0.5 Allowed 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.91 2.406 . . . . 1.47 111.582 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 67.7 mtm-85 -51.08 -49.48 60.56 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.114 0.483 . . . . 4.87 111.422 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.51 -39.23 79.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.42 -0.809 . . . . 2.58 112.899 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 32.4 mt -86.91 -34.0 19.53 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.098 0.777 . . . . 0.85 113.098 -177.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LYS . . . . . 0.549 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 0.4 OUTLIER -68.2 -20.97 64.88 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.681 -0.408 . . . . 2.36 111.115 -179.407 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -70.15 -21.69 63.05 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.064 0.459 . . . . 2.57 109.906 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 42.7 mttm -77.91 -45.94 22.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.659 -0.701 . . . . 2.44 110.653 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 103' ' ' LYS . 4.0 pp -65.11 -24.69 67.5 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 110.148 -0.316 . . . . 1.27 110.148 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 60.3 m -60.95 -37.75 83.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.111 0.481 . . . . 1.15 110.152 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 28.0 ttm180 -72.95 -37.29 67.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.88 -0.6 . . . . 3.6 109.724 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 60.3 t -62.85 -49.43 83.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.711 -0.677 . . . . 1.25 110.411 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.549 HG21 HD11 ' A' ' 131' ' ' LEU . 93.3 t -59.48 -36.61 65.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.746 -0.661 . . . . 1.11 110.595 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -59.91 -54.28 48.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.165 -0.471 . . . . 1.74 110.467 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 55.8 mt -62.09 -40.14 86.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.94 -0.573 . . . . 1.21 110.879 -179.385 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.47 ' HA ' ' CG1' ' A' ' 118' ' ' ILE . 5.6 mp -63.82 -34.71 78.52 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.885 -0.598 . . . . 1.33 112.323 -179.244 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.6 ptmm? -90.27 -37.94 13.75 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.417 0.525 . . . . 1.69 112.417 -178.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -72.94 -36.03 67.11 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.347 0.499 . . . . 2.2 112.347 -178.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -95.05 5.62 51.37 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.947 -0.301 . . . . 3.23 111.298 -178.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 51.51 71.23 0.46 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.445 0.64 . . . . 2.0 110.629 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.47 ' CG1' ' HA ' ' A' ' 113' ' ' LEU . 30.3 mm -83.94 -42.8 17.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.77 -0.65 . . . . 0.61 110.288 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -115.07 177.94 4.47 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.075 -0.511 . . . . 1.26 110.051 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.2 t -68.7 159.89 31.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.375 -0.375 . . . . 1.3 110.464 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 45.4 mtmt -56.46 -41.53 76.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.872 -0.604 . . . . 2.85 111.573 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -61.89 -37.61 85.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.012 -0.54 . . . . 2.95 110.497 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.459 ' O ' HG13 ' A' ' 127' ' ' ILE . 68.1 t -70.95 -46.15 69.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.961 -0.563 . . . . 1.28 110.462 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.415 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 88.0 t -56.35 -46.78 81.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.153 -0.476 . . . . 1.23 110.62 179.754 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -63.03 -36.29 83.08 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.816 -0.629 . . . . 1.74 110.844 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -67.9 -40.06 83.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 1.44 110.305 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 123' ' ' VAL . 85.3 mt -63.72 -47.08 92.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.187 -0.46 . . . . 0.47 110.272 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 124' ' ' VAL . 43.8 mt-10 -58.23 -50.87 72.04 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.867 -0.606 . . . . 2.05 111.286 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 12.0 ptm180 -64.81 -26.03 68.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.432 -0.349 . . . . 3.98 111.599 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 74.0 m -68.47 -37.42 80.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.074 0.464 . . . . 0.7 110.343 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.549 HD11 HG21 ' A' ' 110' ' ' VAL . 29.5 mt -76.43 -41.87 46.07 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.856 -0.611 . . . . 1.33 110.595 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.03 99.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.853 -0.612 . . . . 0.69 111.8 -179.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.47 -30.44 71.56 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.256 -0.429 . . . . 0.84 111.427 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.34 -21.19 64.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 1.12 110.887 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 71.7 mt -99.28 3.13 46.07 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.074 -0.512 . . . . 4.04 110.403 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -99.36 29.03 4.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.898 -0.592 . . . . 6.64 110.474 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 9.1 t60 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.405 -0.807 . . . . 8.0 110.306 179.828 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 206' ' ' PRO . . . . . 0.444 ' HG2' ' HB2' ' A' ' 18' ' ' SER . 31.4 Cg_exo . . . . . 0 CA--C 1.532 0.391 0 N-CA-C 113.006 0.348 . . . . 7.47 113.006 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 17.5 m 63.35 93.68 0.05 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.441 0.638 . . . . 6.02 112.354 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 208' ' ' TYR . . . . . 0.59 ' HA ' ' OE1' ' A' ' 19' ' ' GLN . 34.7 t80 -75.93 131.15 39.45 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.981 -0.554 . . . . 4.07 111.235 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 209' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -58.95 -27.19 84.04 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.318 2.012 . . . . 4.35 112.102 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.63 7.15 47.24 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.801 -0.636 . . . . 4.95 110.825 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 54.4 m -136.92 87.69 19.06 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 3.16 110.586 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 213' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.74 -62.73 0.23 Allowed 'Trans proline' 0 CA--C 1.531 0.372 0 C-N-CA 123.26 2.64 . . . . 4.03 113.465 -179.336 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 67.0 m . . . . . 0 C--O 1.244 0.805 0 CA-C-O 118.54 -0.743 . . . . 5.57 110.064 -179.842 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.453 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 14.0 pt20 . . . . . 0 N--CA 1.462 0.159 0 N-CA-C 111.849 0.314 . . . . 2.75 111.849 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -82.87 -43.49 16.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.132 0.492 . . . . 0.91000000000000003 110.083 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.77 -40.27 87.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.499 -0.773 . . . . 0.85999999999999999 112.396 -179.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 19.4 m -65.13 -37.72 88.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.692 0.282 . . . . 1.4199999999999999 111.632 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.506 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 16.8 mmmt -69.36 -33.88 73.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.698 -0.228 . . . . 1.3 111.124 -179.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.3 mt -66.58 -23.86 66.26 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.947 0.404 . . . . 1.5700000000000001 111.277 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -98.05 2.98 49.34 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.235 -0.439 . . . . 1.5900000000000001 111.841 -179.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.4 p -120.37 15.39 12.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.026 0.441 . . . . 1.6299999999999999 111.059 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 69.7 mt -97.05 165.73 11.93 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.371 0.605 . . . . 1.1000000000000001 111.674 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.447 ' HG2' ' N ' ' A' ' 17' ' ' ASP . 35.3 tt0 -134.09 166.94 21.57 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.198 -1.038 . . . . 2.1600000000000001 108.198 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.447 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 6.0 p-10 -72.77 5.83 2.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.815 0.34 . . . . 1.9399999999999999 111.293 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.9 t -84.26 139.67 32.18 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.474 -0.33 . . . . 1.6100000000000001 110.422 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -62.0 -33.02 73.56 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.166 -0.47 . . . . 2.6400000000000001 110.306 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.02 -28.45 69.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.791 -0.641 . . . . 2.9900000000000002 110.165 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 t -81.26 -53.47 6.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.924 -0.58 . . . . 1.1000000000000001 110.606 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.0 mm -56.66 -43.34 78.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.389 -0.368 . . . . 0.88 110.86 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.6 t -60.88 -35.19 75.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 1.1799999999999999 111.113 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.6 m -64.05 -32.98 74.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.267 -0.424 . . . . 1.1599999999999999 111.934 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.421 ' HB2' HD21 ' A' ' 15' ' ' LEU . . . -90.84 -35.73 14.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.87 0.367 . . . . 0.45000000000000001 110.869 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 22.4 t -62.74 -49.34 75.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.114 -0.493 . . . . 1.3200000000000001 110.664 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.41 -22.6 67.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 2.3799999999999999 110.638 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.481 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 62.1 t90 -78.91 -32.36 45.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.924 -0.58 . . . . 0.97999999999999998 109.865 179.113 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.692 HD11 HG11 ' A' ' 39' ' ' VAL . 11.5 tp -81.88 -36.83 27.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.917 -0.583 . . . . 1.3 110.883 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 79.2 mt -61.47 -22.55 65.17 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.609 0.596 . . . . 1.0600000000000001 112.609 -179.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 4.3 pp -85.79 -9.37 57.17 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.646 -0.422 . . . . 1.71 111.187 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -123.21 56.45 1.18 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.605 0.717 . . . . 1.51 110.563 -179.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 27.0 p90 -64.01 -7.12 7.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.597 -0.729 . . . . 1.6100000000000001 112.371 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -65.04 -34.26 78.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.027 0.441 . . . . 3.9700000000000002 110.662 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -96.74 23.7 6.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.757 -0.656 . . . . 1.7 111.501 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -52.37 -54.51 41.21 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 112.601 0.593 . . . . 0.42999999999999999 112.601 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.34 -29.11 46.4 Favored 'Trans proline' 0 C--N 1.355 0.89 0 C-N-CA 121.563 1.509 . . . . 0.5 112.34 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -72.71 -46.14 55.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.931 -0.577 . . . . 2.7799999999999998 111.226 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.692 HG11 HD11 ' A' ' 29' ' ' LEU . 35.8 m -71.74 -26.19 25.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.781 -0.368 . . . . 0.39000000000000001 110.6 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.94 -47.8 67.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.111 -0.495 . . . . 0.32000000000000001 111.194 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -69.85 -36.23 75.37 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.825 -0.35 . . . . 1.3999999999999999 110.448 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.2 mtm -63.89 -42.64 97.41 Favored 'General case' 0 CA--C 1.522 -0.129 0 N-CA-C 109.754 -0.462 . . . . 1.51 109.754 178.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 73.9 t90 -61.09 -47.09 87.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.575 -0.739 . . . . 0.40999999999999998 109.463 178.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.464 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 37.3 ttpt -59.23 -51.46 69.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.362 -0.835 . . . . 1.1100000000000001 110.606 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -58.78 -43.71 90.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.013 -0.539 . . . . 1.96 111.589 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -60.41 -47.32 86.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.313 -0.403 . . . . 1.5800000000000001 111.37 -179.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 55.5 mtp -72.0 -11.76 60.92 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.77 0.285 . . . . 0.69999999999999996 111.77 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 67.3 mt -95.17 -8.61 35.82 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.755 0.312 . . . . 0.88 110.65 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -79.89 130.02 68.5 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.331 -0.395 . . . . 2.6899999999999999 110.472 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.15 -8.95 24.86 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.937 2.425 . . . . 0.93999999999999995 112.436 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.43 -17.88 50.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.293 0.568 . . . . 1.3300000000000001 110.133 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 76.9 t -89.3 111.06 22.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 CA-C-N 115.394 -0.821 . . . . 0.58999999999999997 110.41 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -69.17 163.1 25.64 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.915 -0.584 . . . . 1.8 110.898 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.4 -34.98 59.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 0.81000000000000005 111.878 -179.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 40.2 mmm-85 -58.45 -48.13 81.75 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.173 0.511 . . . . 3.5800000000000001 110.49 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 36.7 mmt-85 -71.58 -35.73 70.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.789 -0.641 . . . . 3.0499999999999998 110.761 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.3 mttt -61.72 -48.32 81.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.818 0.342 . . . . 0.58999999999999997 110.372 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 24.2 tp -63.74 -37.03 85.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.149 -0.478 . . . . 1.26 110.409 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -64.44 -45.18 88.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.983 -0.553 . . . . 1.54 110.568 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.5 -31.01 77.48 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.912 -0.661 . . . . 0.37 112.015 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 43.4 tp -64.47 -36.95 85.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.959 0.409 . . . . 1.23 110.51 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -63.4 -40.17 96.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.016 -0.538 . . . . 1.3799999999999999 110.85 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 27.0 tp -62.99 -36.51 83.79 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.182 -0.463 . . . . 1.45 111.029 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.448 ' O ' HG22 ' A' ' 68' ' ' VAL . 14.3 tmm? -65.84 -46.6 77.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.271 -0.422 . . . . 0.60999999999999999 110.296 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -59.34 -39.1 82.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.075 -0.512 . . . . 1.6899999999999999 110.772 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -63.44 -56.83 13.07 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.625 -0.716 . . . . 1.54 111.849 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 27.8 m -62.71 -38.98 83.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 113.28 0.844 . . . . 1.3999999999999999 113.28 -177.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.448 HG22 ' O ' ' A' ' 64' ' ' MET . 32.6 m -73.91 -28.43 24.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 120.447 -0.501 . . . . 0.42999999999999999 111.718 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -78.51 -45.56 21.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.776 0.322 . . . . 2.02 110.468 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -71.58 -17.94 62.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.311 -0.404 . . . . 2.1000000000000001 110.875 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.49 -22.98 67.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.204 -0.453 . . . . 0.51000000000000001 111.097 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.4 mmtt -63.19 -36.59 84.14 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.279 -0.418 . . . . 2.0899999999999999 110.589 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -80.23 -28.81 47.74 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.741 -0.743 . . . . 0.66000000000000003 111.886 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -80.1 -22.26 42.37 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.795 0.331 . . . . 1.6200000000000001 110.279 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm 65.73 29.3 10.76 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.449 -0.796 . . . . 2.7000000000000002 111.111 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 33.1 mm -104.15 92.87 2.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.514 -0.767 . . . . 0.63 109.508 179.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 17.3 pt -70.3 -14.57 18.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.935 -0.575 . . . . 0.85999999999999999 111.304 -179.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 17.6 mp0 -55.69 -39.06 70.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.37 -0.377 . . . . 2.2200000000000002 110.81 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -69.23 -50.68 45.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.117 -0.492 . . . . 1.3400000000000001 110.766 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -63.89 -34.61 78.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.729 -0.669 . . . . 1.3 111.44 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.479 ' O ' ' HG2' ' A' ' 85' ' ' LYS . 6.7 t70 -67.54 -50.79 56.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.973 0.416 . . . . 1.3200000000000001 110.456 179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.7 m -66.05 -44.64 83.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.795 -0.639 . . . . 0.93999999999999995 111.981 -179.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -75.49 -27.18 58.7 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 121.04 -0.264 . . . . 1.23 111.534 -179.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.71 -44.51 89.34 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.807 -0.711 . . . . 0.34000000000000002 113.261 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' A' ' 81' ' ' ASP . 2.3 ptpp? -65.96 -27.4 68.12 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.05 0.389 . . . . 1.3100000000000001 112.05 -179.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 35.3 m -93.8 -21.8 5.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 120.742 -0.383 . . . . 0.38 111.075 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' ' 91' ' ' LEU . . . -62.84 -43.07 99.77 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.275 -0.42 . . . . 0.38 110.98 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.58 -35.42 70.37 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.117 0.484 . . . . 0.45000000000000001 110.998 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.648 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 6.1 tp10 -76.28 -56.29 4.78 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.97 -0.559 . . . . 1.5600000000000001 110.279 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 70.5 t -56.91 -46.75 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.236 -0.438 . . . . 0.34000000000000002 112.052 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.447 ' HB2' ' O ' ' A' ' 87' ' ' ALA . 2.4 mm? -60.23 -39.76 87.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.685 0.278 . . . . 1.45 110.587 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -67.93 -27.88 73.56 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.666 -0.778 . . . . 0.40999999999999998 112.248 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.648 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 11.8 mmt85 -80.48 -50.9 9.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.666 0.27 . . . . 3.46 111.014 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.418 ' HA ' ' HG2' ' A' ' 97' ' ' GLU . 41.8 pt -64.56 -31.88 55.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 111.808 0.299 . . . . 0.5 111.808 -178.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -68.8 -17.37 64.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.701 0.286 . . . . 1.0 111.385 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 11.5 pt20 -106.93 8.12 30.37 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 122.014 -0.429 . . . . 1.1399999999999999 111.776 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 6.2 pt-20 -129.79 -30.5 2.04 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.711 0.291 . . . . 1.3300000000000001 111.096 178.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -71.47 139.52 84.08 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.382 -0.372 . . . . 1.3899999999999999 111.055 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.456 ' HD2' HD12 ' A' ' 102' ' ' LEU . 37.0 Cg_endo -66.9 177.09 3.79 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.92 2.413 . . . . 1.47 112.337 178.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.522 ' O ' ' HG2' ' A' ' 103' ' ' LYS . 17.1 mmm-85 -57.33 -44.3 84.13 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.476 0.547 . . . . 4.8700000000000001 112.476 -178.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.23 -32.62 74.15 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.673 0.249 . . . . 2.5800000000000001 111.673 -178.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.456 HD12 ' HD2' ' A' ' 99' ' ' PRO . 15.6 mt -83.46 -35.54 24.87 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.823 -0.351 . . . . 0.84999999999999998 111.497 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 100' ' ' ARG . 10.9 ptmm? -63.02 -33.17 74.86 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.915 0.388 . . . . 2.3599999999999999 109.972 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 47.2 mttt -67.65 -39.6 84.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.058 -0.519 . . . . 2.5699999999999998 110.645 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.499 ' O ' HG23 ' A' ' 109' ' ' VAL . 81.9 mttt -66.14 -42.77 88.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.786 -0.643 . . . . 2.4399999999999999 110.679 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 103' ' ' LYS . 3.7 pp -72.51 -23.03 60.96 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.626 -0.429 . . . . 1.27 110.588 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 61.7 m -61.91 -45.08 95.26 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 116.53 -0.305 . . . . 1.1499999999999999 110.537 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -73.52 -27.98 61.65 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.805 -0.358 . . . . 3.6000000000000001 110.493 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.55 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 94.5 t -68.52 -47.22 78.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.335 -0.393 . . . . 1.25 110.209 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.422 ' HA ' HD12 ' A' ' 113' ' ' LEU . 9.3 p -75.69 -24.8 17.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 1.1100000000000001 110.746 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -65.26 -48.4 73.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.283 -0.417 . . . . 1.74 110.479 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.444 HG22 ' O ' ' A' ' 109' ' ' VAL . 11.4 tt -63.61 -26.19 40.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.376 -0.375 . . . . 1.21 110.867 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 87.5 mt -67.59 -41.99 83.21 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.765 0.317 . . . . 1.3300000000000001 111.003 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -84.49 -26.52 28.08 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.807 -0.357 . . . . 1.6899999999999999 111.0 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -71.49 -35.36 70.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.833 0.349 . . . . 2.2000000000000002 110.818 179.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 31.5 mmm180 -94.13 3.37 55.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.252 -0.431 . . . . 3.23 111.001 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 52.09 56.83 7.2 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.454 0.645 . . . . 2.0 110.433 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 44.5 mm -72.47 -46.45 55.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.457 -0.792 . . . . 0.60999999999999999 111.116 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -105.55 170.46 7.88 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.265 -0.425 . . . . 1.26 110.994 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.16 147.09 53.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.958 -0.565 . . . . 1.3 110.302 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -57.24 -29.2 63.59 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.931 0.396 . . . . 2.8500000000000001 111.343 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -59.56 -47.66 84.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.969 -0.559 . . . . 2.9500000000000002 111.578 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.528 ' O ' HG13 ' A' ' 127' ' ' ILE . 10.8 p -84.86 -31.27 7.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.295 -0.411 . . . . 1.28 111.274 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 39.0 t -59.34 -43.1 89.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 120.913 0.387 . . . . 1.23 110.381 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -67.69 -20.25 65.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.804 -0.635 . . . . 1.74 111.045 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -83.35 -36.12 24.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.985 0.421 . . . . 1.4399999999999999 110.266 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . 0.528 HG13 ' O ' ' A' ' 123' ' ' VAL . 42.2 mt -68.04 -51.32 50.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.156 -0.474 . . . . 0.46999999999999997 110.875 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.58 -38.41 84.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.37 -0.377 . . . . 2.0499999999999998 111.84 -179.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 15.3 ptp180 -71.21 -33.85 70.3 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.738 -0.385 . . . . 3.98 110.65 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 67.8 m -65.16 -38.59 91.06 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.03 0.443 . . . . 0.69999999999999996 110.225 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 127' ' ' ILE . 58.2 mt -65.74 -40.2 91.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.846 -0.616 . . . . 1.3300000000000001 109.947 179.369 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.7 -33.85 66.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.784 -0.643 . . . . 0.68999999999999995 111.103 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.47 -37.54 86.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.928 0.394 . . . . 0.83999999999999997 111.126 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 116.05 -0.523 . . . . 1.1200000000000001 110.888 180.0 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 . . . . . 0 CA--C 1.529 0.157 0 CA-C-O 121.036 0.446 . . . . 2.75 111.108 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -87.22 -40.36 14.62 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.102 -0.499 . . . . 0.91000000000000003 110.059 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.39 -38.85 92.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.738 -0.665 . . . . 0.85999999999999999 111.623 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.83 -29.78 69.79 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.327 -0.397 . . . . 1.4199999999999999 110.83 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.485 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 62.4 mmtt -71.8 -42.91 66.5 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 120.973 0.416 . . . . 1.3 110.625 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.92 -23.53 67.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.832 -0.622 . . . . 1.5700000000000001 111.395 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -95.21 5.04 52.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.163 -0.471 . . . . 1.5900000000000001 112.028 -178.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 p -130.61 20.47 5.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 1.6299999999999999 111.253 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 52.0 mt -102.87 133.17 48.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.865 0.364 . . . . 1.1000000000000001 111.577 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -100.32 173.69 6.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.601 -0.727 . . . . 2.1600000000000001 109.359 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -80.83 35.57 0.37 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.408 0.623 . . . . 1.9399999999999999 110.896 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.483 ' HB3' ' OG ' ' A' ' 21' ' ' SER . 4.0 t -107.26 136.95 46.2 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.102 -0.499 . . . . 1.6100000000000001 109.735 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.412 ' H ' ' HG2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -57.87 -44.0 86.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.935 -0.575 . . . . 2.6400000000000001 111.289 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -62.97 -39.47 94.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.688 0.28 . . . . 2.9900000000000002 111.432 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.483 ' OG ' ' HB3' ' A' ' 18' ' ' SER . 4.7 m -62.43 -50.56 71.01 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.356 -0.384 . . . . 1.1000000000000001 110.387 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.9 mm -63.42 -38.43 82.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.261 -0.427 . . . . 0.88 109.983 179.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 47.0 t -60.31 -39.34 86.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.936 -0.574 . . . . 1.1799999999999999 110.539 179.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.4 m -61.09 -45.42 94.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 1.1599999999999999 110.752 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.12 -34.29 66.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.397 -0.365 . . . . 0.45000000000000001 110.827 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 44.0 t -62.7 -50.75 69.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.972 -0.558 . . . . 1.3200000000000001 110.373 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -59.12 -37.12 76.46 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.133 0.492 . . . . 2.3799999999999999 110.495 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.453 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 9.3 t90 -66.39 -39.13 88.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.379 -0.828 . . . . 0.97999999999999998 110.724 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.7 tp -76.05 -35.51 59.41 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.406 -0.361 . . . . 1.3 111.015 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 78.4 mt -60.18 -32.02 70.68 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.179 -0.464 . . . . 1.0600000000000001 112.248 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 2.8 pp -78.62 -26.66 45.33 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.793 -0.363 . . . . 1.71 111.21 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -98.1 48.74 1.0 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.627 0.727 . . . . 1.51 110.669 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.6 p90 -70.9 -4.22 23.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.462 -0.79 . . . . 1.6100000000000001 111.467 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -70.54 -30.09 66.73 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.168 -0.679 . . . . 3.9700000000000002 109.168 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -107.94 31.87 5.18 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.202 -0.908 . . . . 1.7 110.091 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.456 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -51.57 -51.6 68.12 Favored Pre-proline 0 CA--C 1.537 0.452 0 CA-C-N 115.653 -0.703 . . . . 0.42999999999999999 112.097 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 32.8 Cg_endo -64.42 -31.63 61.55 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 121.582 1.521 . . . . 0.5 111.822 179.212 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 42' ' ' MET . 0.6 OUTLIER -67.5 -47.74 69.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.866 -0.606 . . . . 2.7799999999999998 111.247 -179.255 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.2 m -71.97 -27.51 27.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 C-N-CA 120.705 -0.398 . . . . 0.39000000000000001 110.322 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.13 -47.27 62.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.166 -0.47 . . . . 0.32000000000000001 110.426 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -68.66 -35.91 77.87 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.226 -0.443 . . . . 1.3999999999999999 109.992 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.413 ' HB2' ' O ' ' A' ' 38' ' ' LYS . 14.7 ttm -64.26 -42.85 96.28 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.06 -0.518 . . . . 1.51 110.119 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 61.9 t90 -60.14 -52.08 66.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.446 -0.797 . . . . 0.40999999999999998 110.674 179.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.0 ttpt -61.03 -50.22 74.23 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.633 -0.712 . . . . 1.1100000000000001 111.629 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -61.46 -33.66 74.12 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.307 -0.406 . . . . 1.96 112.045 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -73.9 -44.51 55.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.628 0.251 . . . . 1.5800000000000001 111.004 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 62.6 mtp -70.48 -13.46 62.13 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.002 0.371 . . . . 0.69999999999999996 112.002 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 49.9 mt -92.93 2.15 56.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.943 0.401 . . . . 0.88 110.609 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 59.2 mtp180 -88.0 136.5 32.21 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.105 -0.498 . . . . 2.6899999999999999 110.443 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -68.98 -12.61 34.78 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.793 2.328 . . . . 0.93999999999999995 112.337 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.44 -6.35 56.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.791 -0.641 . . . . 1.3300000000000001 111.191 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 42.3 t -100.38 118.53 47.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.94 0.4 . . . . 0.58999999999999997 110.798 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -74.68 158.45 33.57 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.799 -0.637 . . . . 1.8 110.223 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -33.23 62.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.403 -0.362 . . . . 0.81000000000000005 111.781 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.0 mmm-85 -59.48 -44.74 92.98 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.142 -0.481 . . . . 3.5800000000000001 110.939 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.403 ' HD3' ' HA ' ' A' ' 56' ' ' ARG . 12.4 mmt180 -75.84 -30.35 58.92 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.436 -0.347 . . . . 3.0499999999999998 110.88 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -64.16 -41.98 96.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.03 0.443 . . . . 0.58999999999999997 109.888 179.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 25.6 tp -66.41 -40.57 89.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.832 -0.622 . . . . 1.26 110.216 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -64.53 -41.83 96.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.051 -0.522 . . . . 1.54 110.388 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.19 -36.68 93.17 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.791 -0.719 . . . . 0.37 111.619 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 30.6 tp -63.8 -35.9 82.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.937 0.399 . . . . 1.23 110.122 178.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -65.09 -41.21 95.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.862 -0.608 . . . . 1.3799999999999999 110.773 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 23.9 tp -64.94 -42.47 94.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.262 -0.426 . . . . 1.45 110.495 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 14.1 tmm? -61.52 -45.64 93.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.033 -0.53 . . . . 0.60999999999999999 110.154 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -61.36 -36.32 79.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.83 -0.623 . . . . 1.6899999999999999 111.089 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.564 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 4.3 t-80 -67.05 -56.88 8.16 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.744 -0.662 . . . . 1.54 111.456 -179.442 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 35.0 m -59.74 -39.29 79.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.218 0.821 . . . . 1.3999999999999999 113.218 -177.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 34.7 m -71.12 -27.31 29.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 120.466 -0.494 . . . . 0.42999999999999999 112.049 -178.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 62.7 mt-30 -73.68 -46.44 46.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.942 0.401 . . . . 2.02 110.131 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.564 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 37.5 mm-40 -74.58 -21.33 59.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.863 -0.608 . . . . 2.1000000000000001 110.934 -179.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.58 -35.01 71.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.304 -0.407 . . . . 0.51000000000000001 111.1 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -74.68 -20.81 59.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.86 0.362 . . . . 2.0899999999999999 110.634 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -73.77 -32.54 59.05 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.698 -0.763 . . . . 0.66000000000000003 111.241 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -97.69 -0.76 44.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.186 0.517 . . . . 1.6200000000000001 109.87 179.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.8 mmmm 63.19 40.68 8.63 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.12 -0.945 . . . . 2.7000000000000002 111.252 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.3 mm -100.25 86.28 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.091 -0.504 . . . . 0.63 109.783 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 25.2 pt -68.78 -18.6 23.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.847 -0.615 . . . . 0.85999999999999999 111.489 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -59.47 -41.49 89.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.09 -0.505 . . . . 2.2200000000000002 110.834 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -66.68 -50.68 62.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.852 -0.613 . . . . 1.3400000000000001 111.188 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -62.06 -34.47 76.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.674 -0.694 . . . . 1.3 111.885 -178.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.49 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 13.8 t70 -71.26 -53.68 13.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.706 0.288 . . . . 1.3200000000000001 110.359 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.9 m -59.28 -44.09 92.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.882 -0.599 . . . . 0.93999999999999995 112.04 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -77.29 -35.82 54.76 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.771 0.285 . . . . 1.23 111.771 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.85 -41.21 97.59 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 121.178 -0.534 . . . . 0.34000000000000002 114.039 -178.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.49 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 12.7 ptpt -65.71 -31.12 71.94 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.324 0.49 . . . . 1.3100000000000001 112.324 -178.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.3 m -95.83 -19.38 6.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.64 -0.424 . . . . 0.38 111.241 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.68 -42.14 99.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.394 -0.367 . . . . 0.38 111.242 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.29 -41.71 80.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.439 . . . . 0.45000000000000001 110.985 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.622 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 6.3 tp10 -67.0 -54.04 25.57 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.902 -0.59 . . . . 1.5600000000000001 110.493 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 96.0 t -59.3 -45.65 93.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 0.34000000000000002 111.607 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -56.78 -44.16 81.58 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.538 -0.301 . . . . 1.45 111.293 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -66.97 -37.19 91.97 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.454 -0.879 . . . . 0.40999999999999998 112.424 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.622 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 9.8 mmt180 -68.17 -48.4 65.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.696 0.284 . . . . 3.46 110.958 -179.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.493 ' HA ' ' HG2' ' A' ' 97' ' ' GLU . 45.2 pt -70.08 -23.88 25.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.079 0.466 . . . . 0.5 111.043 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . 0.486 ' ND2' ' HB3' ' A' ' 134' ' ' ALA . 7.1 t30 -65.79 -24.67 66.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.975 -0.557 . . . . 1.0 110.832 179.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.522 ' HB3' ' HB1' ' A' ' 134' ' ' ALA . 9.6 pt20 -110.63 1.25 17.9 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.55 0.574 . . . . 1.1399999999999999 112.55 -178.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.493 ' HG2' ' HA ' ' A' ' 94' ' ' ILE . 1.5 pt-20 -117.69 -20.05 9.08 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.864 -0.334 . . . . 1.3300000000000001 111.665 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -80.87 145.77 58.18 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 120.799 0.333 . . . . 1.3899999999999999 111.279 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -66.26 171.78 9.83 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 123.046 2.498 . . . . 1.47 112.164 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -56.99 -42.66 80.65 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.565 0.58 . . . . 4.8700000000000001 112.565 -178.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.21 -46.79 76.02 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 121.133 -0.227 . . . . 2.5800000000000001 111.299 -178.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.487 HD23 ' HD2' ' A' ' 105' ' ' LYS . 36.7 mt -71.81 -29.69 64.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.827 0.346 . . . . 0.84999999999999998 110.67 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . 0.428 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 0.0 OUTLIER -56.02 -50.89 69.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.773 -0.648 . . . . 2.3599999999999999 110.574 179.53 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 57.1 tttt -66.04 -36.07 82.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.265 -0.425 . . . . 2.5699999999999998 110.659 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.487 ' HD2' HD23 ' A' ' 102' ' ' LEU . 88.5 mttt -63.58 -44.06 95.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.148 -0.478 . . . . 2.4399999999999999 110.913 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.473 ' O ' HG12 ' A' ' 109' ' ' VAL . 1.7 pp -74.54 -27.86 60.7 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.974 -0.291 . . . . 1.27 110.693 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 52.4 m -67.47 -41.05 85.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.515 -0.312 . . . . 1.1499999999999999 111.242 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . 0.462 ' O ' HG13 ' A' ' 112' ' ' ILE . 16.3 ptt180 -76.57 -31.75 57.74 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.848 -0.341 . . . . 3.6000000000000001 110.708 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -69.02 -38.92 79.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-O 120.69 0.281 . . . . 1.25 110.637 -179.86 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 8.4 p -80.1 -21.13 11.83 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-O 121.257 0.551 . . . . 1.1100000000000001 110.066 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -68.05 -41.6 81.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.743 -0.662 . . . . 1.74 109.625 179.397 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 108' ' ' ARG . 67.1 mt -62.64 -36.23 74.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.851 -0.613 . . . . 1.21 110.047 179.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 87.7 mt -61.84 -49.34 76.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 1.3300000000000001 111.245 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -75.63 -28.04 58.65 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 121.008 -0.277 . . . . 1.6899999999999999 111.59 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.448 ' HA ' ' OE1' ' A' ' 115' ' ' GLU . 2.6 mm-40 -73.71 -39.2 64.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.711 0.291 . . . . 2.2000000000000002 111.064 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -83.79 -0.6 51.71 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.803 0.335 . . . . 3.23 110.367 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.89 48.42 8.92 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.435 -0.802 . . . . 2.0 110.808 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 42.9 mm -70.42 -46.14 72.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.75 -0.659 . . . . 0.60999999999999999 109.979 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -101.84 164.71 11.58 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.811 -0.631 . . . . 1.26 110.19 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.6 t -68.77 145.82 53.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.211 -0.449 . . . . 1.3 110.162 179.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -59.03 -25.94 64.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.487 -0.324 . . . . 2.8500000000000001 110.778 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -62.39 -38.56 90.08 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.074 -0.512 . . . . 2.9500000000000002 111.09 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.473 ' O ' HG13 ' A' ' 127' ' ' ILE . 12.9 p -90.27 -31.48 5.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.841 -0.344 . . . . 1.28 110.504 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.405 ' O ' ' HG2' ' A' ' 128' ' ' GLU . 47.7 t -59.8 -38.33 75.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 120.984 0.421 . . . . 1.23 110.245 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -62.25 -26.53 68.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.809 -0.632 . . . . 1.74 110.77 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.528 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 38.7 t70 -87.28 -36.67 17.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.351 -0.386 . . . . 1.4399999999999999 110.205 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . 0.521 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 77.2 mt -60.89 -50.51 80.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.226 -0.443 . . . . 0.46999999999999997 110.723 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 124' ' ' VAL . 4.6 pt-20 -63.73 -37.29 86.79 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.396 -0.365 . . . . 2.0499999999999998 111.578 -179.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.528 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 6.5 ptp180 -70.34 -32.47 70.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.621 -0.263 . . . . 3.98 110.852 -179.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 49.0 m -65.89 -40.2 91.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.885 0.374 . . . . 0.69999999999999996 110.394 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 127' ' ' ILE . 23.8 mt -66.26 -44.41 83.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.988 -0.551 . . . . 1.3300000000000001 110.245 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.91 -36.63 78.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.886 -0.597 . . . . 0.68999999999999995 111.715 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -59.25 -46.18 89.19 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.963 0.357 . . . . 0.83999999999999997 111.963 -179.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . 0.522 ' HB1' ' HB3' ' A' ' 96' ' ' GLN . . . . . . . . 0 C--N 1.324 -0.524 0 CA-C-O 120.855 0.359 . . . . 1.1200000000000001 111.468 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 . . . . . 0 C--O 1.23 0.048 0 CA-C-O 120.834 0.349 . . . . 2.75 110.617 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -64.13 -47.38 80.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.945 -0.57 . . . . 0.91000000000000003 110.285 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -39.14 93.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.06 -0.518 . . . . 0.85999999999999999 110.881 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 12.2 m -63.36 -35.89 81.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.964 -0.562 . . . . 1.4199999999999999 110.59 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.503 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 65.4 mmtt -65.04 -41.86 94.82 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.046 -0.524 . . . . 1.3 110.247 179.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -62.0 -34.49 76.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.853 -0.612 . . . . 1.5700000000000001 111.235 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -77.98 -5.67 52.0 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.992 -0.549 . . . . 1.5900000000000001 111.695 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 p -123.83 18.56 9.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.815 0.34 . . . . 1.6299999999999999 111.604 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 17.0 mt -95.16 169.11 10.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.087 0.47 . . . . 1.1000000000000001 111.39 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -139.79 -174.27 3.86 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.72 -0.673 . . . . 2.1600000000000001 109.215 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -91.5 12.1 21.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.779 0.323 . . . . 1.9399999999999999 111.424 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.478 ' O ' HG12 ' A' ' 22' ' ' ILE . 0.1 OUTLIER -85.41 132.25 34.25 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.867 -0.419 . . . . 1.6100000000000001 109.867 179.093 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -29.37 70.29 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.69 0.281 . . . . 2.6400000000000001 110.749 -179.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 -67.55 -44.09 79.1 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.811 -0.44 . . . . 2.9900000000000002 109.811 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.1 m -64.63 -41.24 96.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.929 -0.578 . . . . 1.1000000000000001 109.922 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 18' ' ' SER . 38.3 mm -63.41 -49.0 84.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 N-CA-C 109.257 -0.645 . . . . 0.88 109.257 178.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.8 m -57.28 -35.8 70.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.127 -0.488 . . . . 1.1799999999999999 111.001 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.5 t -59.82 -40.07 87.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.456 . . . . 1.1599999999999999 111.077 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.5 -43.65 13.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.319 -0.401 . . . . 0.45000000000000001 111.206 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.405 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 37.9 m -59.36 -41.31 88.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.255 -0.43 . . . . 1.3200000000000001 111.624 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.524 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 21.2 ttpt -61.95 -35.25 77.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.755 0.312 . . . . 2.3799999999999999 110.194 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.526 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 25.0 t90 -72.81 -40.61 65.7 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.47 -0.567 . . . . 0.97999999999999998 109.47 179.265 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -62.95 -38.46 91.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.831 -0.622 . . . . 1.3 110.756 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 26' ' ' SER . 86.4 mt -63.75 -28.26 69.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.985 0.421 . . . . 1.0600000000000001 110.537 179.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 68.9 mt -76.09 -27.63 57.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.945 -0.571 . . . . 1.71 109.546 178.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' A' ' 28' ' ' TRP . 50.1 mm-40 -97.24 36.86 1.39 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.479 -0.782 . . . . 1.51 110.211 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.8 p90 -67.26 -1.58 4.74 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 121.057 0.456 . . . . 1.6100000000000001 111.304 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -82.83 -8.8 59.55 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.02 -0.536 . . . . 3.9700000000000002 109.86 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -131.39 37.75 3.67 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.687 -0.688 . . . . 1.7 110.343 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.439 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -57.36 -52.23 75.78 Favored Pre-proline 0 CA--C 1.537 0.481 0 CA-C-N 115.869 -0.605 . . . . 0.42999999999999999 112.45 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.442 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 32.4 Cg_endo -64.74 -27.02 60.19 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 121.797 1.665 . . . . 0.5 112.362 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.6 -39.08 77.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.983 -0.553 . . . . 2.7799999999999998 111.091 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 24.6 m -85.59 -22.58 7.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 120.61 -0.436 . . . . 0.39000000000000001 110.669 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.36 -46.08 74.42 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.199 -0.455 . . . . 0.32000000000000001 110.737 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 3.3 pt-20 -64.13 -40.75 96.84 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.257 -0.429 . . . . 1.3999999999999999 110.052 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.422 ' N ' ' HG3' ' A' ' 41' ' ' GLU . 42.5 ttm -64.67 -41.07 96.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.596 -0.729 . . . . 1.51 110.521 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -62.18 -49.48 75.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.743 -0.662 . . . . 0.40999999999999998 110.36 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.458 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 23.2 ttpp -57.82 -51.28 70.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.921 -0.581 . . . . 1.1100000000000001 111.04 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.416 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 11.4 mm-40 -61.28 -38.65 87.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.144 -0.48 . . . . 1.96 111.168 -179.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.436 ' O ' HG21 ' A' ' 52' ' ' VAL . 79.1 t80 -62.03 -46.65 88.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.921 0.391 . . . . 1.5800000000000001 110.67 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 76.9 mmm -67.05 -25.2 66.14 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.2 -0.454 . . . . 0.69999999999999996 111.407 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 82.0 mt -93.94 12.7 25.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.396 -0.365 . . . . 0.88 111.299 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 11.9 mtp85 -96.66 133.56 24.39 Favored Pre-proline 0 C--N 1.327 -0.401 0 N-CA-C 110.333 -0.247 . . . . 2.6899999999999999 110.333 179.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -70.28 -15.89 35.26 Favored 'Trans proline' 0 CA--C 1.53 0.284 0 C-N-CA 122.924 2.416 . . . . 0.93999999999999995 113.307 -179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.69 10.47 7.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.032 0.444 . . . . 1.3300000000000001 110.946 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.436 HG21 ' O ' ' A' ' 46' ' ' TYR . 41.2 t -110.39 122.0 64.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.949 -0.569 . . . . 0.58999999999999997 110.514 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -69.01 156.45 38.6 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.96 -0.564 . . . . 1.8 110.93 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.12 -41.81 72.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.876 0.369 . . . . 0.81000000000000005 111.73 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -68.89 -29.81 68.17 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.423 -0.353 . . . . 3.5800000000000001 110.497 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.0 mmm-85 -70.96 -38.68 72.82 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.602 -0.518 . . . . 3.0499999999999998 109.602 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -67.21 -34.82 78.3 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.377 -0.601 . . . . 0.58999999999999997 109.377 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 20.1 tp -63.05 -37.97 89.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.581 -0.736 . . . . 1.26 109.927 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 mp -66.25 -40.59 90.3 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.688 -0.687 . . . . 1.54 110.007 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.66 -33.79 88.18 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.916 -0.659 . . . . 0.37 111.562 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.84 -44.13 86.41 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.391 -0.596 . . . . 1.23 109.391 178.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -61.78 -39.47 91.81 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.284 -0.871 . . . . 1.3799999999999999 110.876 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 20.2 tp -63.6 -41.28 98.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.928 -0.578 . . . . 1.45 110.389 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.484 ' O ' HG22 ' A' ' 68' ' ' VAL . 16.9 tmm? -62.87 -51.57 66.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.886 -0.597 . . . . 0.60999999999999999 110.699 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -56.11 -35.52 67.15 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.063 0.458 . . . . 1.6899999999999999 110.923 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -68.67 -58.12 4.7 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.709 -0.678 . . . . 1.54 111.687 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 17.5 m -60.52 -39.86 82.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 113.052 0.76 . . . . 1.3999999999999999 113.052 -177.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.484 HG22 ' O ' ' A' ' 64' ' ' MET . 30.7 m -72.96 -31.03 34.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 120.515 -0.474 . . . . 0.42999999999999999 111.88 -178.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -77.7 -43.09 32.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.954 0.407 . . . . 2.02 110.473 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -71.52 -24.89 62.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.197 -0.456 . . . . 2.1000000000000001 110.588 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.29 -18.72 65.52 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.297 -0.41 . . . . 0.51000000000000001 110.566 179.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt -68.29 -29.21 67.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.27 -0.423 . . . . 2.0899999999999999 109.879 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.2 -47.73 28.68 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.965 -0.636 . . . . 0.66000000000000003 111.574 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -78.75 -7.68 58.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.919 0.39 . . . . 1.6200000000000001 110.289 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.7 mttp 60.46 40.27 17.37 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.489 -0.778 . . . . 2.7000000000000002 111.267 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 40.1 mm -93.25 94.79 4.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.766 -0.652 . . . . 0.63 109.813 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 10.9 pt -70.73 -22.47 23.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.083 -0.508 . . . . 0.85999999999999999 111.224 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -56.23 -33.46 65.41 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.916 0.389 . . . . 2.2200000000000002 110.702 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -71.51 -53.44 13.85 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.934 -0.576 . . . . 1.3400000000000001 110.577 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -63.88 -31.54 72.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.82 -0.627 . . . . 1.3 111.799 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -71.23 -57.36 4.56 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.964 0.412 . . . . 1.3200000000000001 111.426 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.9 m -65.36 -42.35 92.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.878 -0.601 . . . . 0.93999999999999995 112.327 -178.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -78.32 -28.66 47.38 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.7 -0.4 . . . . 1.23 111.184 -179.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -68.23 -42.9 82.09 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.777 -0.725 . . . . 0.34000000000000002 113.051 -179.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -65.3 -27.12 68.39 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.019 0.377 . . . . 1.3100000000000001 112.019 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.6 m -97.26 -18.29 6.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-O 120.772 0.32 . . . . 0.38 111.316 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.23 -45.53 91.2 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.254 -0.43 . . . . 0.38 111.382 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -50.88 -46.69 60.56 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.386 0.429 . . . . 0.45000000000000001 111.515 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.596 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 3.5 tp10 -62.43 -60.03 4.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.76 -0.654 . . . . 1.5600000000000001 110.529 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.452 ' O ' HG12 ' A' ' 94' ' ' ILE . 80.0 t -54.97 -49.4 71.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.837 -0.619 . . . . 0.34000000000000002 112.363 -178.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 82.0 mt -61.09 -38.0 84.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.611 0.243 . . . . 1.45 111.629 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -72.22 -31.06 64.2 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.544 -0.836 . . . . 0.40999999999999998 112.0 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.596 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 47.8 mmm-85 -76.59 -50.35 14.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.514 0.197 . . . . 3.46 111.233 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.452 HG12 ' O ' ' A' ' 90' ' ' VAL . 22.2 pt -65.18 -20.82 28.24 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.282 0 CA-C-O 120.609 0.242 . . . . 0.5 111.167 -179.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -62.86 -26.8 68.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.687 0.755 . . . . 1.0 109.677 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -101.59 2.94 39.48 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.469 -0.787 . . . . 1.1399999999999999 110.785 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -116.65 -15.87 10.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.134 -0.485 . . . . 1.3300000000000001 111.281 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -95.1 125.63 49.77 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.22 -0.446 . . . . 1.3899999999999999 111.193 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -61.79 174.5 2.28 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.719 2.279 . . . . 1.47 112.042 178.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.416 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 14.6 ptt-85 -49.95 -33.46 17.71 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.835 0.68 . . . . 4.8700000000000001 112.835 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -75.07 -52.77 10.22 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.928 -0.309 . . . . 2.5800000000000001 111.683 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 35.5 mt -66.75 -35.63 80.56 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.225 0.454 . . . . 0.84999999999999998 112.225 -178.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -65.83 -30.18 70.76 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.857 -0.337 . . . . 2.3599999999999999 110.821 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 100' ' ' ARG . 43.1 mtmt -68.63 -23.87 64.48 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.329 0.585 . . . . 2.5699999999999998 109.748 178.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 52.9 mttp -84.14 -28.95 27.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.446 -0.797 . . . . 2.4399999999999999 108.977 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 26.1 tp -64.51 -45.33 87.74 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.498 -0.774 . . . . 1.27 109.823 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 1.4 p -63.87 -25.87 68.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 1.1499999999999999 110.674 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 39.3 mtt-85 -72.61 -24.35 61.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.949 -0.569 . . . . 3.6000000000000001 110.982 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.5 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 49.0 t -91.48 -48.77 13.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 116.081 -0.509 . . . . 1.25 110.105 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 71.8 t -56.66 -44.36 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.67 -0.695 . . . . 1.1100000000000001 112.187 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.93 -38.46 91.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.616 0.246 . . . . 1.74 111.256 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 57.9 mt -71.02 -40.05 75.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.801 0.334 . . . . 1.21 110.777 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 89.5 mt -58.72 -39.52 81.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 1.3300000000000001 111.913 -179.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 11.7 ptpt -83.08 -40.86 19.3 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.976 -0.289 . . . . 1.6899999999999999 111.759 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -66.71 -33.83 76.49 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.034 0.383 . . . . 2.2000000000000002 112.034 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.7 mmm180 -85.73 0.04 53.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.751 -0.204 . . . . 3.23 110.993 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 56.14 52.03 10.95 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.33 0.586 . . . . 2.0 110.116 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 49.7 mm -77.35 -49.12 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.837 -0.62 . . . . 0.60999999999999999 110.481 -179.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -102.25 171.98 7.16 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.087 -0.506 . . . . 1.26 110.327 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.22 158.83 35.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.998 -0.547 . . . . 1.3 110.341 179.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.417 ' O ' ' HB2' ' A' ' 125' ' ' ASN . 2.0 mmmt -57.41 -39.82 76.99 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.515 -0.311 . . . . 2.8500000000000001 111.584 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -66.66 -27.77 67.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.749 0.309 . . . . 2.9500000000000002 111.141 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 90.0 t -80.73 -51.22 16.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.47 -0.332 . . . . 1.28 111.243 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.516 ' O ' ' HG2' ' A' ' 128' ' ' GLU . 26.9 m -61.74 -30.2 47.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.772 0.32 . . . . 1.23 111.131 -179.451 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -72.29 -27.32 62.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.208 -0.451 . . . . 1.74 110.654 179.589 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -79.16 -36.27 40.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.187 -0.46 . . . . 1.4399999999999999 110.023 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 81.3 mt -63.4 -54.61 30.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.873 -0.603 . . . . 0.46999999999999997 111.049 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 124' ' ' VAL . 5.2 pt-20 -61.59 -38.68 88.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.351 -0.386 . . . . 2.0499999999999998 111.794 -178.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -68.15 -29.25 68.1 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.751 -0.38 . . . . 3.98 110.724 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 65.0 m -72.17 -40.36 68.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.839 0.352 . . . . 0.69999999999999996 110.161 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.1 mp -64.12 -39.42 93.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.191 0.519 . . . . 1.3300000000000001 109.922 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.05 -42.28 63.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.502 -0.772 . . . . 0.68999999999999995 111.213 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.44 -25.58 67.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.83999999999999997 111.274 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.424 0 CA-C-N 116.096 -0.502 . . . . 1.1200000000000001 110.75 179.406 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.481 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 18.5 mt-30 . . . . . 0 C--O 1.226 -0.152 0 N-CA-C 111.521 0.193 . . . . 2.75 111.521 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.618 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 82.4 t80 -77.12 -43.94 32.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.039 0.447 . . . . 0.91000000000000003 110.785 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.0 -41.22 96.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.907 -0.588 . . . . 0.85999999999999999 112.358 -179.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.9 t -69.39 -24.39 63.86 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.709 -0.223 . . . . 1.4199999999999999 111.408 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 71.2 mmtt -68.11 -37.62 81.35 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.973 0.416 . . . . 1.3 110.052 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -62.22 -32.59 73.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.602 -0.726 . . . . 1.5700000000000001 111.153 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 54.8 m-20 -77.57 -11.32 59.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.108 -0.496 . . . . 1.5900000000000001 111.287 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.99 9.66 18.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.843 0.354 . . . . 1.6299999999999999 111.465 -179.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 15' ' ' LEU . 17.9 mt -85.94 165.0 17.1 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.129 0.49 . . . . 1.1000000000000001 111.372 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -144.18 169.58 17.61 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.581 -0.736 . . . . 2.1600000000000001 109.458 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -84.38 41.9 0.86 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.425 0.631 . . . . 1.9399999999999999 111.453 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -119.33 139.23 52.3 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.991 -0.55 . . . . 1.6100000000000001 109.708 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.2 pm0 -61.39 -39.58 91.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.679 -0.237 . . . . 2.6400000000000001 111.016 -179.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.77 -42.22 99.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.123 0.487 . . . . 2.9900000000000002 110.258 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.8 m -65.28 -46.98 78.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.025 -0.534 . . . . 1.1000000000000001 111.012 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 38.4 mm -65.39 -44.98 94.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 CA-C-N 116.354 -0.384 . . . . 0.88 110.235 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.9 t -56.18 -43.38 78.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.876 -0.602 . . . . 1.1799999999999999 111.082 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.0 m -59.21 -36.85 76.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.247 -0.433 . . . . 1.1599999999999999 111.868 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -83.01 -40.52 19.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.767 0.318 . . . . 0.45000000000000001 111.111 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.6 m -62.29 -43.64 98.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.301 -0.409 . . . . 1.3200000000000001 111.038 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.623 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 0.3 OUTLIER -64.06 -38.74 92.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.318 -0.401 . . . . 2.3799999999999999 110.095 179.67 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 37.5 t90 -64.89 -38.57 91.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.025 -0.534 . . . . 0.97999999999999998 110.287 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -67.09 -45.31 77.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.98 -0.555 . . . . 1.3 111.142 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 74.1 mt -64.26 -21.37 66.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.961 -0.563 . . . . 1.0600000000000001 112.052 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 66.0 mt -70.64 -24.45 62.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.752 0.311 . . . . 1.71 110.991 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.15 72.08 1.45 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.087 0.47 . . . . 1.51 110.991 -179.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.5 p90 -75.17 9.18 2.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.94 -0.573 . . . . 1.6100000000000001 110.729 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 33.1 mtp-105 -71.0 -25.1 62.54 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.782 -0.644 . . . . 3.9700000000000002 110.499 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -117.13 33.3 5.69 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.128 -0.487 . . . . 1.7 110.645 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.428 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -54.62 -51.65 76.71 Favored Pre-proline 0 CA--C 1.538 0.485 0 CA-C-N 115.512 -0.767 . . . . 0.42999999999999999 112.282 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.428 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 35.5 Cg_endo -66.03 -29.49 48.62 Favored 'Trans proline' 0 C--N 1.356 0.936 0 C-N-CA 121.602 1.535 . . . . 0.5 112.182 179.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.6 tptm -70.58 -45.96 64.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.46 -0.336 . . . . 2.7799999999999998 110.867 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 35.5 m -72.64 -25.79 23.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 120.837 -0.345 . . . . 0.39000000000000001 110.49 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.37 -50.12 49.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 0.32000000000000001 110.655 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -66.67 -35.32 79.86 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 110.207 -0.294 . . . . 1.3999999999999999 110.207 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.618 ' SD ' ' HB3' ' A' ' 8' ' ' PHE . 57.0 ttm -66.48 -40.82 89.52 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.02 0.438 . . . . 1.51 109.839 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -60.29 -49.13 78.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.508 -0.769 . . . . 0.40999999999999998 109.503 178.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -57.39 -46.68 83.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.092 -0.958 . . . . 1.1100000000000001 110.837 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -62.97 -43.89 97.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.801 -0.636 . . . . 1.96 111.413 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.43 ' O ' HG21 ' A' ' 52' ' ' VAL . 81.2 t80 -64.67 -45.14 87.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.884 0.373 . . . . 1.5800000000000001 111.227 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 56.4 mmm -67.4 -22.53 65.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.138 -0.483 . . . . 0.69999999999999996 112.051 -178.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.7 mt -103.72 32.35 3.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.917 0.389 . . . . 0.88 111.579 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 59.3 mtp180 -113.76 144.02 30.64 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 116.364 -0.38 . . . . 2.6899999999999999 110.567 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.35 -16.31 31.18 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.833 2.355 . . . . 0.93999999999999995 112.613 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.05 4.8 21.58 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.014 -0.539 . . . . 1.3300000000000001 111.255 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.43 HG21 ' O ' ' A' ' 46' ' ' TYR . 41.3 t -115.33 120.9 66.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.299 -0.41 . . . . 0.58999999999999997 110.789 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -74.41 155.16 38.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.842 -0.617 . . . . 1.8 110.614 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.65 -36.96 62.67 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 122.876 0.47 . . . . 0.81000000000000005 112.214 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -35.02 78.84 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.961 0.41 . . . . 3.5800000000000001 110.451 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.4 mmm-85 -73.9 -37.21 64.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.079 -0.51 . . . . 3.0499999999999998 110.544 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 78.3 mttt -65.83 -32.25 73.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.049 -0.523 . . . . 0.58999999999999997 109.755 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 32.0 tp -66.48 -40.64 89.41 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.072 -0.714 . . . . 1.26 109.072 178.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.6 mp -68.62 -39.81 80.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.503 -0.771 . . . . 1.54 110.187 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.34 -34.89 90.66 Favored Glycine 0 N--CA 1.452 -0.273 0 N-CA-C 111.58 -0.608 . . . . 0.37 111.58 179.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.2 tt -66.62 -39.97 88.58 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.335 -0.617 . . . . 1.23 109.335 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -61.32 -40.27 93.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.592 -0.731 . . . . 1.3799999999999999 110.823 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.8 tp -62.16 -45.65 92.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.206 -0.452 . . . . 1.45 110.302 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.486 ' O ' HG22 ' A' ' 68' ' ' VAL . 16.0 tmm? -62.93 -47.17 84.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.854 -0.612 . . . . 0.60999999999999999 109.838 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -56.45 -39.11 72.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.51 -0.768 . . . . 1.6899999999999999 111.525 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -69.36 -53.0 21.72 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.004 -0.543 . . . . 1.54 111.447 -179.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 34.4 m -63.39 -32.6 57.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 112.731 0.641 . . . . 1.3999999999999999 112.731 -178.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.486 HG22 ' O ' ' A' ' 64' ' ' MET . 34.5 m -80.07 -31.95 13.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.446 -0.502 . . . . 0.42999999999999999 111.67 -179.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -75.48 -35.74 60.77 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.982 0.42 . . . . 2.02 110.594 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -84.09 -11.65 56.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.209 -0.45 . . . . 2.1000000000000001 111.315 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.6 -23.46 66.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.445 -0.343 . . . . 0.51000000000000001 111.087 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.4 ' HD3' HE22 ' A' ' 80' ' ' GLN . 3.4 mmmp? -66.77 -38.36 86.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.253 -0.431 . . . . 2.0899999999999999 110.386 179.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -73.32 -30.52 62.5 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.923 -0.655 . . . . 0.66000000000000003 111.658 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -81.13 -15.49 55.71 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.817 0.342 . . . . 1.6200000000000001 110.329 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 62.9 mttp 65.1 26.67 12.51 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.446 -0.797 . . . . 2.7000000000000002 110.679 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 36.7 mm -109.68 86.37 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.638 -0.71 . . . . 0.63 109.423 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.409 HG13 ' OE1' ' A' ' 78' ' ' GLN . 2.0 pp -73.11 -12.05 15.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.123 -0.489 . . . . 0.85999999999999999 110.753 -179.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.409 ' OE1' HG13 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -59.74 -35.57 74.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.962 -0.563 . . . . 2.2200000000000002 110.165 179.321 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.51 -43.7 89.25 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.299 0.571 . . . . 1.3400000000000001 109.5 178.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.4 HE22 ' HD3' ' A' ' 72' ' ' LYS . 75.2 mt-30 -68.92 -36.97 78.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.194 -0.912 . . . . 1.3 111.191 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.406 ' O ' ' HG2' ' A' ' 85' ' ' LYS . 30.2 t70 -69.96 -43.95 70.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.901 0.382 . . . . 1.3200000000000001 110.931 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . 0.43 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 39.8 m -62.87 -44.44 96.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.052 -0.522 . . . . 0.93999999999999995 111.193 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -79.22 -33.39 43.76 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-N 116.318 -0.401 . . . . 1.23 111.297 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.15 -44.27 94.9 Favored Glycine 0 N--CA 1.453 -0.226 0 N-CA-C 114.211 0.445 . . . . 0.34000000000000002 114.211 -178.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.43 ' HE2' ' HA ' ' A' ' 82' ' ' SER . 0.0 OUTLIER -66.18 -20.88 66.27 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.204 0.446 . . . . 1.3100000000000001 112.204 -178.772 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 20.4 m -106.41 -17.2 7.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.898 0.38 . . . . 0.38 110.902 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.76 -46.98 85.52 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.131 -0.486 . . . . 0.38 111.011 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.49 -40.43 71.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.254 -0.43 . . . . 0.45000000000000001 110.735 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -66.27 -58.61 4.98 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.805 -0.634 . . . . 1.5600000000000001 110.169 179.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.514 ' O ' HG12 ' A' ' 94' ' ' ILE . 81.7 t -56.02 -49.72 73.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.945 -0.571 . . . . 0.34000000000000002 111.905 -178.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 94.8 mt -59.03 -43.45 91.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.817 -0.174 . . . . 1.45 111.424 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -65.82 -32.29 82.39 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.757 -0.735 . . . . 0.40999999999999998 112.401 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 34.7 mmm-85 -77.55 -52.93 8.24 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.528 0.204 . . . . 3.46 111.245 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.514 HG12 ' O ' ' A' ' 90' ' ' VAL . 37.9 pt -66.97 -18.8 24.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.452 -0.34 . . . . 0.5 111.361 -179.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -61.64 -30.93 71.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.394 0.616 . . . . 1.0 109.812 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -85.74 -14.98 43.62 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.576 -0.738 . . . . 1.1399999999999999 110.375 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -92.11 -38.12 12.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.907 -0.588 . . . . 1.3300000000000001 110.773 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 -67.28 122.03 81.16 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.566 -0.743 . . . . 1.3899999999999999 111.383 -179.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -71.85 -175.88 1.84 Allowed 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.476 2.117 . . . . 1.47 112.337 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 15.9 ptt-85 -55.56 -27.37 48.76 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 113.119 0.785 . . . . 4.8700000000000001 113.119 -178.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . 0.44 ' HA ' ' CE ' ' A' ' 104' ' ' LYS . 33.4 t70 -81.15 -46.09 15.42 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.654 -0.418 . . . . 2.5800000000000001 111.845 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 22.5 mt -73.86 -29.2 61.97 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.363 0.505 . . . . 0.84999999999999998 112.363 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 57.1 pttt -58.85 -28.42 66.06 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.792 0.329 . . . . 2.3599999999999999 111.149 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.44 ' CE ' ' HA ' ' A' ' 101' ' ' ASP . 41.0 mtmt -64.42 -50.91 65.72 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.04 0.448 . . . . 2.5699999999999998 110.599 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 40.9 mttp -68.47 -33.55 74.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.854 -0.612 . . . . 2.4399999999999999 110.093 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 16.6 tp -63.39 -48.26 78.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.717 -0.674 . . . . 1.27 110.641 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.8 p -66.57 -33.57 75.96 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.941 -0.304 . . . . 1.1499999999999999 110.796 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 39.0 mtt180 -64.08 -52.43 59.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.157 -0.474 . . . . 3.6000000000000001 111.472 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.482 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 6.2 p -61.48 -42.17 92.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 121.085 -0.246 . . . . 1.25 110.961 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 50.5 t -60.4 -43.89 94.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 121.017 0.437 . . . . 1.1100000000000001 110.175 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.424 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 2.7 t-20 -60.11 -47.34 86.29 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.589 -0.732 . . . . 1.74 110.693 179.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 78.8 mt -63.59 -44.35 98.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.305 -0.407 . . . . 1.21 111.139 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 87.1 mt -60.28 -44.01 95.73 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.973 0.36 . . . . 1.3300000000000001 111.973 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.424 ' HG3' ' O ' ' A' ' 111' ' ' ASN . 2.0 ptpt -75.1 -35.4 61.76 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.91 -0.316 . . . . 1.6899999999999999 111.506 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -71.07 -27.07 63.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.634 0.255 . . . . 2.2000000000000002 111.282 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 6.4 mtt-85 -90.76 -4.0 57.0 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.67 -0.493 . . . . 3.23 109.67 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 56.09 54.89 7.37 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.089 -0.959 . . . . 2.0 110.16 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 37.8 mm -73.86 -45.83 48.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.344 -0.844 . . . . 0.60999999999999999 110.602 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -100.31 171.53 7.72 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.966 -0.561 . . . . 1.26 110.736 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.8 163.08 20.09 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.931 -0.577 . . . . 1.3 111.224 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.3 mmmp? -55.4 -43.38 75.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 2.8500000000000001 111.683 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.92 -23.05 64.12 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.016 -0.538 . . . . 2.9500000000000002 111.659 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 61.4 t -85.19 -49.18 15.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 121.144 -0.223 . . . . 1.28 111.26 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 27.8 m -61.17 -30.54 48.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.883 0.373 . . . . 1.23 111.181 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -80.84 -28.46 36.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 1.74 110.86 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.45 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 10.9 t70 -73.41 -40.55 64.18 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.017 0.437 . . . . 1.4399999999999999 110.179 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 91.0 mt -60.62 -52.51 60.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.98 -0.555 . . . . 0.46999999999999997 111.526 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -63.11 -33.98 76.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.227 0.454 . . . . 2.0499999999999998 112.227 -178.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 13.1 ptt180 -74.81 -33.81 62.26 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.426 -0.51 . . . . 3.98 110.943 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 39.3 m -66.04 -44.62 84.1 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.983 0.42 . . . . 0.69999999999999996 110.734 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.5 mp -62.04 -36.83 82.77 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.119 -0.491 . . . . 1.3300000000000001 110.447 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.36 -41.15 66.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.785 -0.643 . . . . 0.68999999999999995 110.851 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.05 -34.11 74.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.366 -0.379 . . . . 0.83999999999999997 111.432 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.447 . . . . 1.1200000000000001 111.177 179.803 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.429 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 97.0 mt-30 . . . . . 0 C--O 1.228 -0.05 0 CA-C-O 121.091 0.472 . . . . 2.75 109.737 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -72.6 -49.57 31.24 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.86 -0.609 . . . . 0.91000000000000003 110.11 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -36.67 80.21 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.784 -0.644 . . . . 0.85999999999999999 112.015 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.1 t -72.66 -26.95 61.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.455 -0.339 . . . . 1.4199999999999999 110.674 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.429 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 22.6 mmmt -69.37 -27.78 65.62 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-O 120.701 0.286 . . . . 1.3 110.589 179.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.86 -29.87 71.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.956 -0.566 . . . . 1.5700000000000001 110.577 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -81.48 -20.8 39.44 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.054 -0.521 . . . . 1.5900000000000001 110.496 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.2 p -101.16 24.69 9.09 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.066 -0.515 . . . . 1.6299999999999999 111.554 -179.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 15' ' ' LEU . 15.8 mt -77.36 165.44 24.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.037 0.446 . . . . 1.1000000000000001 111.373 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -144.88 168.25 20.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.82 -0.627 . . . . 2.1600000000000001 109.377 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -82.62 -20.85 35.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.663 0.268 . . . . 1.9399999999999999 111.316 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.455 ' HB2' ' OG ' ' A' ' 21' ' ' SER . 3.5 m -61.61 133.87 56.15 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 1.6100000000000001 111.082 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.02 -34.89 79.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.85 -0.614 . . . . 2.6400000000000001 110.554 -178.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -66.15 -38.66 88.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.821 -0.627 . . . . 2.9900000000000002 110.745 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.455 ' OG ' ' HB2' ' A' ' 18' ' ' SER . 4.3 m -68.16 -38.9 82.61 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.147 -0.479 . . . . 1.1000000000000001 110.163 179.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.9 mm -67.32 -34.97 72.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 N-CA-C 109.047 -0.723 . . . . 0.88 109.047 178.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.0 m -63.26 -33.78 76.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.185 -0.916 . . . . 1.1799999999999999 111.179 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.1 m -62.43 -47.58 83.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 1.1599999999999999 110.722 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.35 -40.66 81.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.101 -0.5 . . . . 0.45000000000000001 110.632 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 29.1 t -61.32 -48.89 79.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.025 -0.534 . . . . 1.3200000000000001 110.771 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -26.8 68.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 2.3799999999999999 111.1 -179.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 13.9 t90 -78.15 -37.83 45.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.153 -0.476 . . . . 0.97999999999999998 110.169 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -67.52 -35.4 79.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.669 -0.696 . . . . 1.3 110.911 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.7 -23.9 67.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.408 -0.36 . . . . 1.0600000000000001 111.774 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 68.4 mt -81.09 -20.75 40.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.074 0.464 . . . . 1.71 111.065 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -110.27 41.45 1.74 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.11 0.481 . . . . 1.51 110.443 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 54.6 p90 -59.11 -20.6 54.95 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.802 -0.635 . . . . 1.6100000000000001 112.098 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.3 ttp180 -71.47 -25.49 62.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.034 0.445 . . . . 3.9700000000000002 110.711 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.33 16.97 25.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.897 -0.592 . . . . 1.7 110.739 -179.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.503 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.38 -50.88 77.27 Favored Pre-proline 0 CA--C 1.536 0.404 0 CA-C-N 115.735 -0.666 . . . . 0.42999999999999999 112.51 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 18.1 Cg_endo -59.81 -31.69 94.32 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 121.83 1.687 . . . . 0.5 112.708 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.3 tptt -76.57 -41.22 47.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.318 -0.401 . . . . 2.7799999999999998 111.345 -178.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.1 m -73.17 -29.77 29.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 C-N-CA 120.396 -0.522 . . . . 0.39000000000000001 110.546 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.83 -46.41 71.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.185 -0.461 . . . . 0.32000000000000001 111.34 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 7.4 pt-20 -64.84 -40.78 95.72 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 110.049 -0.352 . . . . 1.3999999999999999 110.049 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 65.7 mtm -65.47 -37.31 86.47 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.961 0.41 . . . . 1.51 109.945 179.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 63.5 t90 -59.55 -48.27 82.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.493 -0.776 . . . . 0.40999999999999998 109.742 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.405 ' HE3' HD12 ' A' ' 48' ' ' LEU . 8.9 ttpt -60.83 -45.07 95.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.209 -0.451 . . . . 1.1100000000000001 110.676 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.536 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 10.0 mm-40 -60.53 -47.09 87.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.963 -0.562 . . . . 1.96 110.851 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -65.43 -44.18 88.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 1.5800000000000001 111.115 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 70.3 mmm -66.16 -22.98 66.39 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.104 0.409 . . . . 0.69999999999999996 112.104 -179.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.405 HD12 ' HE3' ' A' ' 44' ' ' LYS . 51.3 mt -99.68 7.47 45.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.602 0.239 . . . . 0.88 111.487 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.536 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 41.9 mtp180 -84.92 132.57 45.49 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.954 -0.387 . . . . 2.6899999999999999 109.954 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -67.07 -11.69 33.23 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.754 2.303 . . . . 0.93999999999999995 112.59 -179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -16.43 59.24 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.171 0.51 . . . . 1.3300000000000001 110.6 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.2 t -92.18 123.87 44.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.799 -0.637 . . . . 0.58999999999999997 110.769 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -69.61 153.31 43.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.795 -0.639 . . . . 1.8 110.601 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.35 -39.69 64.35 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.017 -0.538 . . . . 0.81000000000000005 112.354 -179.477 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -68.82 -32.6 72.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.845 0.355 . . . . 3.5800000000000001 110.954 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.7 mmt85 -71.45 -32.65 68.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.314 -0.403 . . . . 3.0499999999999998 110.016 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.1 mttt -67.65 -34.29 76.66 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.452 -0.573 . . . . 0.58999999999999997 109.452 178.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 40.8 tp -63.3 -43.64 97.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.773 -0.648 . . . . 1.26 109.797 178.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 94.1 mt -65.47 -40.76 93.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.812 -0.631 . . . . 1.54 110.034 179.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.9 -30.69 78.46 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.983 -0.627 . . . . 0.37 111.743 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 25.8 tp -71.78 -38.82 70.25 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.918 0.389 . . . . 1.23 110.138 178.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -65.96 -31.37 72.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.961 -0.563 . . . . 1.3799999999999999 110.568 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 56.7 tp -65.73 -44.5 85.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.956 -0.565 . . . . 1.45 110.627 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.474 ' HG3' ' N ' ' A' ' 65' ' ' ASN . 0.0 OUTLIER -67.13 -34.61 77.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.60999999999999999 110.841 -179.61 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.474 ' N ' ' HG3' ' A' ' 64' ' ' MET . 11.2 t30 -63.44 -37.29 86.73 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.343 0.592 . . . . 1.6899999999999999 110.528 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -68.22 -52.87 29.3 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.382 -0.826 . . . . 1.54 111.295 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.417 HG12 ' HA ' ' A' ' 64' ' ' MET . 7.1 p -63.43 -39.42 85.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 112.9 0.704 . . . . 1.3999999999999999 112.9 -177.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.465 HG22 ' O ' ' A' ' 64' ' ' MET . 33.5 m -73.57 -24.58 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 C-N-CA 120.416 -0.514 . . . . 0.42999999999999999 111.517 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -75.18 -47.66 27.3 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.111 -0.329 . . . . 2.02 110.111 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -72.08 -23.16 61.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.186 -0.461 . . . . 2.1000000000000001 110.732 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.09 -29.09 70.07 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-N 116.392 -0.367 . . . . 0.51000000000000001 111.125 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.479 ' HD2' ' HA ' ' A' ' 118' ' ' ILE . 42.8 mtpt -68.01 -34.88 77.34 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.441 -0.345 . . . . 2.0899999999999999 110.371 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.46 -30.4 75.08 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.924 -0.655 . . . . 0.66000000000000003 111.753 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -95.62 -2.09 48.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.731 0.3 . . . . 1.6200000000000001 110.447 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm 62.01 23.75 14.04 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.686 -0.688 . . . . 2.7000000000000002 112.121 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 23.3 mm -86.36 78.91 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.861 -0.422 . . . . 0.63 109.861 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 10.3 pt -64.42 -11.71 10.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.861 -0.609 . . . . 0.85999999999999999 111.71 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.96 -26.75 68.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.095 -0.502 . . . . 2.2200000000000002 110.492 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -73.5 -51.23 17.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 1.3400000000000001 110.865 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -63.96 -28.65 69.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 1.3 111.311 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -73.24 -50.28 23.22 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.208 0.527 . . . . 1.3200000000000001 109.968 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . 0.436 ' HA ' ' HE3' ' A' ' 85' ' ' LYS . 23.4 m -64.4 -47.1 80.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.455 -0.793 . . . . 0.93999999999999995 111.65 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -76.77 -30.22 56.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.605 0.24 . . . . 1.23 111.308 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.7 -42.21 93.38 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.078 -0.582 . . . . 0.34000000000000002 113.479 -179.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.436 ' HE3' ' HA ' ' A' ' 82' ' ' SER . 9.7 ptpt -60.55 -27.06 67.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.752 0.276 . . . . 1.3100000000000001 111.539 -179.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.416 HG13 ' HG3' ' A' ' 85' ' ' LYS . 17.1 m -103.29 -14.64 8.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.707 0.289 . . . . 0.38 111.564 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.74 -44.61 93.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.427 -0.351 . . . . 0.38 111.323 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.27 -36.81 69.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.098 0.475 . . . . 0.45000000000000001 111.016 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 5.8 tp10 -72.69 -58.61 3.22 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.598 -0.728 . . . . 1.5600000000000001 110.62 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 96.2 t -54.91 -50.34 62.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.85 -0.614 . . . . 0.34000000000000002 112.107 -178.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.534 HD13 HD11 ' A' ' 94' ' ' ILE . 3.3 mm? -58.24 -42.22 85.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.531 0.205 . . . . 1.45 111.355 -179.119 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -67.66 -35.06 85.24 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.573 -0.823 . . . . 0.40999999999999998 112.426 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 15.8 mmp_? -75.68 -48.76 20.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.548 0.213 . . . . 3.46 111.566 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.534 HD11 HD13 ' A' ' 91' ' ' LEU . 43.5 pt -65.97 -25.46 36.09 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 C-N-CA 121.062 -0.255 . . . . 0.5 111.589 -178.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -63.15 -21.79 66.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.432 0.634 . . . . 1.0 110.189 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -97.27 -33.73 11.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.722 -0.672 . . . . 1.1399999999999999 110.804 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -76.3 -32.83 58.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 1.3300000000000001 111.055 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -80.82 132.83 56.4 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.12 -0.491 . . . . 1.3899999999999999 110.226 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.408 ' HD2' HD12 ' A' ' 102' ' ' LEU . 28.7 Cg_endo -63.42 166.35 15.41 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.352 2.035 . . . . 1.47 110.835 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.483 ' HA ' ' HG2' ' A' ' 103' ' ' LYS . 0.0 OUTLIER -59.44 -21.61 60.28 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.945 0.35 . . . . 4.8700000000000001 111.945 -178.758 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.27 -25.79 51.8 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.831 0.348 . . . . 2.5800000000000001 110.969 179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.408 HD12 ' HD2' ' A' ' 99' ' ' PRO . 26.4 mt -98.66 -26.81 14.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.575 -0.284 . . . . 0.84999999999999998 111.736 -178.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . 0.483 ' HG2' ' HA ' ' A' ' 100' ' ' ARG . 0.0 OUTLIER -61.13 -25.19 66.82 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.002 0.429 . . . . 2.3599999999999999 110.541 -179.87 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.548 ' O ' ' HG3' ' A' ' 108' ' ' ARG . 53.2 mttm -65.48 -35.39 80.77 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.028 -0.533 . . . . 2.5699999999999998 110.216 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 18.5 mtpp -69.94 -49.89 47.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.945 -0.57 . . . . 2.4399999999999999 110.925 -179.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.478 ' CD2' ' HA ' ' A' ' 103' ' ' LYS . 3.2 pp -65.78 -27.92 68.63 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.684 0.278 . . . . 1.27 110.657 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.1 t -63.78 -37.64 88.13 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.265 -0.425 . . . . 1.1499999999999999 110.03 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 104' ' ' LYS . 8.3 mtp85 -66.42 -40.66 89.69 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.423 -0.584 . . . . 3.6000000000000001 109.423 179.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.583 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 47.3 t -59.56 -56.95 13.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.159 -0.928 . . . . 1.25 110.732 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 44.7 t -57.85 -41.19 79.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.078 -0.51 . . . . 1.1100000000000001 111.13 -179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -58.92 -49.08 79.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.301 -0.409 . . . . 1.74 110.524 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 96.9 mt -65.18 -38.3 82.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.712 0.291 . . . . 1.21 110.685 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 96.0 mt -59.67 -43.21 94.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.312 -0.404 . . . . 1.3300000000000001 111.231 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -79.94 -33.25 39.81 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.899 -0.321 . . . . 1.6899999999999999 111.07 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -66.0 -44.7 84.01 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.717 0.294 . . . . 2.2000000000000002 111.022 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 85.8 mtt180 -87.03 7.27 28.44 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.548 -0.296 . . . . 3.23 111.103 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 47.84 58.89 4.59 Favored 'General case' 0 C--O 1.235 0.315 0 O-C-N 123.77 0.669 . . . . 2.0 110.84 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.479 ' HA ' ' HD2' ' A' ' 72' ' ' LYS . 40.4 mm -73.65 -48.02 42.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.855 -0.612 . . . . 0.60999999999999999 110.939 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -101.93 174.76 5.8 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.024 -0.535 . . . . 1.26 110.838 -179.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . 0.42 ' O ' HG23 ' A' ' 124' ' ' VAL . 26.7 t -71.18 139.6 50.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.058 -0.519 . . . . 1.3 109.761 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -53.23 -30.35 37.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.417 -0.356 . . . . 2.8500000000000001 111.712 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 6.1 mm100 -61.92 -49.48 76.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.93 0.395 . . . . 2.9500000000000002 111.132 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.533 ' O ' HG13 ' A' ' 127' ' ' ILE . 3.9 p -79.22 -27.89 13.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.301 -0.409 . . . . 1.28 111.032 -179.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 120' ' ' SER . 43.3 t -60.98 -42.21 92.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.206 0.527 . . . . 1.23 109.81 179.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -61.88 -37.89 86.27 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.442 -0.799 . . . . 1.74 110.391 179.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -67.35 -36.48 81.5 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.142 -0.481 . . . . 1.4399999999999999 110.452 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 123' ' ' VAL . 70.1 mt -63.58 -49.33 82.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.084 0.469 . . . . 0.46999999999999997 109.832 178.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -62.06 -40.1 94.64 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.743 -0.662 . . . . 2.0499999999999998 110.544 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 41.7 mmt-85 -62.1 -43.47 98.77 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.255 -0.43 . . . . 3.98 110.354 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 50.7 m -64.44 -37.65 88.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.727 -0.67 . . . . 0.69999999999999996 110.783 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 127' ' ' ILE . 73.5 mt -66.43 -46.01 77.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.35 -0.386 . . . . 1.3300000000000001 110.88 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.14 -29.82 68.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 0.68999999999999995 111.021 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.77 -21.77 64.85 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.028 -0.533 . . . . 0.83999999999999997 111.727 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.421 . . . . 1.1200000000000001 111.108 179.939 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.417 ' O ' HG22 ' A' ' 10' ' ' THR . 9.8 pt20 . . . . . 0 CA--C 1.527 0.073 0 CA-C-O 120.589 0.233 . . . . 2.75 111.252 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -75.16 -43.0 54.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.979 0.418 . . . . 0.91000000000000003 110.052 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.97 -39.16 93.85 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.978 -0.556 . . . . 0.85999999999999999 111.438 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.417 HG22 ' O ' ' A' ' 7' ' ' GLN . 1.2 t -69.83 -24.12 63.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.45 -0.341 . . . . 1.4199999999999999 110.783 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -71.9 -36.83 70.14 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 109.996 -0.372 . . . . 1.3 109.996 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -68.08 -26.99 66.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.951 -0.568 . . . . 1.5700000000000001 110.508 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -70.28 -34.34 72.66 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.742 -0.663 . . . . 1.5900000000000001 110.464 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.6 t -105.2 17.19 24.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.903 -0.59 . . . . 1.6299999999999999 110.442 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.2 126.88 31.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.863 -0.608 . . . . 1.1000000000000001 110.291 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -115.29 151.99 33.56 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.663 -0.699 . . . . 2.1600000000000001 109.557 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -80.19 40.53 0.49 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.506 0.67 . . . . 1.9399999999999999 111.119 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.532 ' O ' HG12 ' A' ' 22' ' ' ILE . 3.5 m -107.18 146.66 31.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.561 -0.745 . . . . 1.6100000000000001 110.063 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.1 -32.96 74.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.066 -0.515 . . . . 2.6400000000000001 110.16 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -66.59 -49.67 65.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.069 -0.514 . . . . 2.9900000000000002 109.838 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.46 ' OG ' ' HB2' ' A' ' 18' ' ' SER . 1.2 m -56.6 -48.77 76.71 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.905 -0.588 . . . . 1.1000000000000001 111.777 -179.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.532 HG12 ' O ' ' A' ' 18' ' ' SER . 9.4 mm -64.44 -45.8 94.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.577 -0.283 . . . . 0.88 110.979 -179.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.7 m -66.4 -39.44 89.03 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 111.827 0.306 . . . . 1.1799999999999999 111.827 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.0 t -59.64 -47.33 86.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.064 0.459 . . . . 1.1599999999999999 110.152 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.36 -34.0 72.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.968 -0.56 . . . . 0.45000000000000001 110.799 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.5 t -59.06 -52.67 64.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.175 -0.466 . . . . 1.3200000000000001 110.283 179.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.7 mmtp -62.97 -37.95 89.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.093 -0.503 . . . . 2.3799999999999999 110.395 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 20.6 t90 -61.7 -39.05 90.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.505 -0.77 . . . . 0.97999999999999998 110.303 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 29' ' ' LEU . 2.2 mm? -74.05 -42.23 60.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.715 -0.675 . . . . 1.3 110.515 179.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 mp -59.85 -23.26 63.24 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.093 -0.503 . . . . 1.0600000000000001 111.585 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 78.3 mt -75.82 -32.04 59.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.458 -0.337 . . . . 1.71 110.528 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -103.08 48.12 0.86 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.58 0.705 . . . . 1.51 110.168 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.442 ' HA ' ' CE2' ' A' ' 79' ' ' PHE . 34.0 p90 -57.89 -23.24 52.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.259 -0.882 . . . . 1.6100000000000001 112.09 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.7 mtp-105 -71.75 -18.73 62.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.912 0.387 . . . . 3.9700000000000002 111.143 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.04 21.72 16.86 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.941 0.4 . . . . 1.7 110.817 -179.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.478 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.26 -49.45 84.9 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 115.446 -0.797 . . . . 0.42999999999999999 112.521 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.588 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 35.3 Cg_endo -65.46 -34.56 42.66 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 121.548 1.499 . . . . 0.5 112.745 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.4 ttmt -66.47 -47.04 74.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.677 0.275 . . . . 2.7799999999999998 111.688 -179.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.445 ' HA ' ' SD ' ' A' ' 42' ' ' MET . 26.9 m -73.14 -22.93 19.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 C-N-CA 120.777 -0.369 . . . . 0.39000000000000001 111.053 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.427 ' HA ' ' CE1' ' A' ' 83' ' ' PHE . . . -71.94 -50.1 31.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.391 -0.368 . . . . 0.32000000000000001 111.029 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 5.0 pt-20 -63.69 -44.32 94.05 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.347 -0.388 . . . . 1.3999999999999999 111.283 -179.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.445 ' SD ' ' HA ' ' A' ' 39' ' ' VAL . 16.5 ptm -65.88 -33.44 75.85 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.484 0.183 . . . . 1.51 110.915 -179.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 64.7 t90 -64.94 -45.49 85.56 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.158 -0.682 . . . . 0.40999999999999998 109.158 178.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.479 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 16.9 ttpt -60.16 -49.5 77.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.277 -0.874 . . . . 1.1100000000000001 110.426 179.293 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.519 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 6.7 mm-40 -58.48 -42.51 87.71 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.04 0.448 . . . . 1.96 110.58 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -63.66 -42.75 98.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.761 -0.654 . . . . 1.5800000000000001 111.217 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 71.6 mmm -72.74 -23.6 60.86 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.129 -0.487 . . . . 0.69999999999999996 112.311 -178.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 71.0 mt -85.27 -16.8 38.92 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 111.942 0.349 . . . . 0.88 111.942 -179.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 57.0 mtm180 -70.67 133.85 86.48 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.737 0.304 . . . . 2.6899999999999999 111.401 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.2 -13.63 20.95 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.858 2.372 . . . . 0.93999999999999995 112.37 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -9.68 58.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.988 -0.551 . . . . 1.3300000000000001 110.793 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 34.0 t -104.63 125.81 59.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.796 -0.638 . . . . 0.58999999999999997 109.743 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -72.74 163.28 28.35 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.057 0.456 . . . . 1.8 111.005 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.22 -34.44 73.66 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.123 0.786 . . . . 0.81000000000000005 113.123 -178.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -62.6 -43.92 97.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.769 0.319 . . . . 3.5800000000000001 110.68 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -65.28 -37.38 87.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 3.0499999999999998 110.359 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -65.77 -36.15 82.74 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.908 -0.587 . . . . 0.58999999999999997 110.327 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 32.9 tp -62.85 -41.32 99.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.125 -0.489 . . . . 1.26 110.032 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.4 mp -69.39 -35.98 76.32 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.03 -0.532 . . . . 1.54 110.16 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.11 -32.46 84.12 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.758 -0.734 . . . . 0.37 111.313 178.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 37.2 tp -68.16 -37.13 80.67 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.97 0.414 . . . . 1.23 110.218 179.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -64.57 -39.47 93.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.842 -0.617 . . . . 1.3799999999999999 110.499 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.0 tp -63.67 -44.61 93.26 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.082 -0.508 . . . . 1.45 110.481 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.429 ' O ' HG22 ' A' ' 68' ' ' VAL . 13.6 tmm? -60.13 -41.58 92.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.013 -0.54 . . . . 0.60999999999999999 109.763 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.505 ' O ' ' HB2' ' A' ' 69' ' ' GLN . 1.4 t30 -60.05 -41.74 92.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.601 -0.727 . . . . 1.6899999999999999 111.301 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -67.79 -47.72 68.32 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.114 0.413 . . . . 1.54 112.114 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 31.1 m -63.33 -32.13 55.35 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 112.669 0.618 . . . . 1.3999999999999999 112.669 -178.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.429 HG22 ' O ' ' A' ' 64' ' ' MET . 34.2 m -88.59 -18.96 7.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.613 -0.435 . . . . 0.42999999999999999 111.09 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.505 ' HB2' ' O ' ' A' ' 65' ' ' ASN . 6.2 tp-100 -76.77 -49.35 16.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 2.02 110.831 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 55.4 mm-40 -82.16 -6.15 58.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.185 -0.461 . . . . 2.1000000000000001 111.035 -179.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.3 -33.47 72.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.317 -0.401 . . . . 0.51000000000000001 111.519 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -67.02 -28.68 68.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.65 -0.25 . . . . 2.0899999999999999 111.24 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.56 -38.53 95.83 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.918 -0.658 . . . . 0.66000000000000003 111.93 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -100.57 0.82 40.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.653 0.263 . . . . 1.6200000000000001 110.743 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? 63.02 37.75 11.47 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.824 -0.626 . . . . 2.7000000000000002 111.009 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.4 mm -92.32 81.86 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.367 0.603 . . . . 0.63 109.755 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 44.1 pt -73.78 -11.37 14.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.616 -0.72 . . . . 0.85999999999999999 111.249 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -61.8 -47.57 84.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.11 -0.496 . . . . 2.2200000000000002 110.628 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.442 ' CE2' ' HA ' ' A' ' 33' ' ' TYR . 8.7 m-85 -64.92 -33.96 77.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.303 -0.408 . . . . 1.3400000000000001 111.214 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -71.58 -26.49 62.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.989 -0.551 . . . . 1.3 111.32 -179.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -87.26 -41.92 13.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.723 0.297 . . . . 1.3200000000000001 110.542 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . 0.457 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 35.0 p -67.3 -52.52 39.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.326 -0.397 . . . . 0.93999999999999995 111.001 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.427 ' CE1' ' HA ' ' A' ' 40' ' ' ALA . 18.9 m-85 -74.31 -31.54 62.52 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.323 -0.398 . . . . 1.23 110.712 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -63.14 -43.64 98.37 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.166 -0.54 . . . . 0.34000000000000002 113.39 -179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.457 ' HE2' ' HA ' ' A' ' 82' ' ' SER . 0.1 OUTLIER -65.47 -24.79 67.25 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.254 0.465 . . . . 1.3100000000000001 112.254 -178.627 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.7 m -104.77 -9.86 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 C-N-CA 120.894 -0.322 . . . . 0.38 111.364 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.22 -48.73 80.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.267 -0.424 . . . . 0.38 111.432 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.04 -41.76 88.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.157 -0.474 . . . . 0.45000000000000001 111.359 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -62.33 -50.31 72.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.888 -0.596 . . . . 1.5600000000000001 110.464 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 92.9 t -65.32 -41.31 91.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.957 -0.565 . . . . 0.34000000000000002 110.936 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -60.87 -48.29 82.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.501 -0.318 . . . . 1.45 111.101 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -64.9 -25.47 70.69 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.589 -0.815 . . . . 0.40999999999999998 111.879 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.599 ' O ' ' HG2' ' A' ' 96' ' ' GLN . 3.8 mmm-85 -78.87 -51.75 9.26 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.435 0.16 . . . . 3.46 111.21 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 46.2 pt -68.09 -22.26 27.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.926 -0.31 . . . . 0.5 111.241 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -65.51 -28.06 68.92 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.927 0.394 . . . . 1.0 110.742 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.599 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 10.0 pt20 -98.49 -11.84 21.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.031 0.443 . . . . 1.1399999999999999 110.767 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -91.43 -37.61 13.09 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.153 -0.476 . . . . 1.3300000000000001 110.628 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -72.99 130.2 85.36 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.265 -0.425 . . . . 1.3899999999999999 109.933 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -52.55 -77.1 0.02 OUTLIER 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 123.317 2.678 . . . . 1.47 113.298 -179.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -155.8 -53.94 0.09 Allowed 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 111.905 0.335 . . . . 4.8700000000000001 111.905 179.478 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -65.24 -33.38 75.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.038 0.447 . . . . 2.5800000000000001 110.838 -179.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 79.5 mt -74.13 -39.01 63.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.174 -0.466 . . . . 0.84999999999999998 110.875 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . 0.479 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 10.6 ptpt -73.11 -8.75 57.14 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 121.336 0.589 . . . . 2.3599999999999999 110.392 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -81.05 -10.76 59.64 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.361 -0.836 . . . . 2.5699999999999998 109.539 178.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -95.26 -30.06 14.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.722 -0.672 . . . . 2.4399999999999999 111.308 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 103' ' ' LYS . 4.2 pp -69.78 -28.27 65.62 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 121.056 0.455 . . . . 1.27 110.233 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.04 -34.57 76.71 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.979 -0.555 . . . . 1.1499999999999999 110.126 179.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 108' ' ' ARG . 40.0 mmt180 -66.57 -51.62 54.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.556 -0.747 . . . . 3.6000000000000001 111.051 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.453 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 2.7 p -65.28 -40.26 88.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.423 -0.353 . . . . 1.25 110.699 -179.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 6.3 t -62.5 -42.8 97.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.864 0.364 . . . . 1.1100000000000001 110.046 179.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -59.26 -47.83 83.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.866 -0.607 . . . . 1.74 109.953 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.437 ' O ' ' HG2' ' A' ' 116' ' ' ARG . 96.8 mt -60.7 -49.72 83.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.996 -0.547 . . . . 1.21 111.335 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 96.0 mt -59.87 -39.15 84.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.331 -0.395 . . . . 1.3300000000000001 111.963 -178.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 4.7 pttp -82.23 -22.93 35.63 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.549 -0.46 . . . . 1.6899999999999999 111.769 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -78.79 -37.0 41.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.923 0.392 . . . . 2.2000000000000002 110.48 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 13.4 mmm-85 -84.67 1.37 46.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.083 -0.508 . . . . 3.23 110.288 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 11.5 m120 57.79 47.79 14.84 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.435 -0.802 . . . . 2.0 111.034 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 31.6 mm -70.17 -50.45 47.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.907 -0.588 . . . . 0.60999999999999999 109.801 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -100.38 158.79 15.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.901 -0.591 . . . . 1.26 110.309 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.8 m -67.32 156.02 37.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.194 -0.457 . . . . 1.3 109.945 179.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 61.3 mtpt -55.77 -34.29 65.12 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.945 0.35 . . . . 2.8500000000000001 111.945 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -59.54 -41.83 90.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.184 0.516 . . . . 2.9500000000000002 110.02 179.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.429 ' O ' HG13 ' A' ' 127' ' ' ILE . 40.7 t -72.27 -45.01 62.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.578 -0.737 . . . . 1.28 110.301 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 76.8 t -57.87 -44.07 85.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.496 . . . . 1.23 110.932 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 42.4 t-20 -58.01 -45.76 86.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.923 -0.58 . . . . 1.74 110.259 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -62.96 -38.82 92.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.984 -0.553 . . . . 1.4399999999999999 111.305 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 123' ' ' VAL . 79.9 mt -66.75 -46.67 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.091 0.472 . . . . 0.46999999999999997 110.775 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 68.5 mt-10 -63.17 -28.86 70.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.151 -0.477 . . . . 2.0499999999999998 110.952 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 21.5 mtm-85 -81.11 -41.08 23.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.24 -0.437 . . . . 3.98 111.984 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 1.2 p -62.71 -33.72 75.69 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.002 0.43 . . . . 0.69999999999999996 110.654 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.6 mp -68.5 -44.25 75.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.169 -0.469 . . . . 1.3300000000000001 110.401 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.84 -37.83 76.29 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.044 -0.526 . . . . 0.68999999999999995 111.735 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -64.44 -19.43 65.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.936 0.398 . . . . 0.83999999999999997 111.426 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 116.109 -0.496 . . . . 1.1200000000000001 111.281 179.793 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.535 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 19.8 mm100 . . . . . 0 C--O 1.226 -0.165 0 CA-C-O 121.067 0.461 . . . . 2.75 110.644 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.521 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 78.5 t80 -79.93 -42.58 23.77 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.923 -0.581 . . . . 0.91000000000000003 109.693 179.114 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.1 m -65.34 -34.54 78.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.65 -0.705 . . . . 0.85999999999999999 111.494 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.07 -35.53 81.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.003 0.43 . . . . 1.4199999999999999 110.719 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.535 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 31.1 mmmt -76.23 -38.81 55.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.056 -0.52 . . . . 1.3 110.584 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -60.97 -29.03 69.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.25 -0.432 . . . . 1.5700000000000001 111.499 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 -83.76 -5.97 59.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.309 -0.405 . . . . 1.5900000000000001 111.855 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.6 t -115.81 -3.27 12.23 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.669 -0.412 . . . . 1.6299999999999999 111.44 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.408 HD21 ' HB2' ' A' ' 25' ' ' ALA . 32.5 mt -72.93 163.07 28.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.52 -0.309 . . . . 1.1000000000000001 111.03 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -143.67 -170.26 3.26 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.708 -0.479 . . . . 2.1600000000000001 109.708 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -76.67 -19.28 57.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.198 0.523 . . . . 1.9399999999999999 110.379 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.56 116.88 2.91 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.587 -0.733 . . . . 1.6100000000000001 110.782 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.47 -35.22 65.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.769 -0.651 . . . . 2.6400000000000001 110.784 -179.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -65.7 -34.09 77.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.853 -0.612 . . . . 2.9900000000000002 110.967 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.5 p -71.41 -40.11 70.69 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.575 -0.528 . . . . 1.1000000000000001 109.575 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.1 mm -66.59 -44.18 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 CA-C-N 115.91 -0.587 . . . . 0.88 109.77 179.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 56.0 m -59.58 -38.01 80.02 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.971 -0.559 . . . . 1.1799999999999999 111.173 179.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.3 m -67.9 -28.69 67.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.809 0.338 . . . . 1.1599999999999999 110.832 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.408 ' HB2' HD21 ' A' ' 15' ' ' LEU . . . -82.78 -44.26 15.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.255 -0.43 . . . . 0.45000000000000001 111.113 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.4 p -62.44 -44.01 97.45 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.726 0.298 . . . . 1.3200000000000001 110.651 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -64.66 -36.96 85.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.982 0.42 . . . . 2.3799999999999999 110.536 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -67.44 -36.16 80.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.267 0.556 . . . . 0.97999999999999998 109.539 178.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -70.86 -39.41 72.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.715 -0.675 . . . . 1.3 110.559 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.0 mt -62.28 -24.91 67.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.303 -0.408 . . . . 1.0600000000000001 110.739 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 24.0 mt -78.55 -16.38 57.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.99 -0.55 . . . . 1.71 111.338 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -120.58 46.5 1.98 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.075 0.464 . . . . 1.51 110.659 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -62.81 -9.69 10.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 1.6100000000000001 111.386 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 77.5 mtt180 -66.28 -35.42 80.34 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.218 0.532 . . . . 3.9700000000000002 110.088 178.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -103.79 27.63 7.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.617 -0.719 . . . . 1.7 110.86 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.478 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.51 -51.32 74.15 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.736 -0.665 . . . . 0.42999999999999999 111.852 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.478 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 33.4 Cg_endo -64.5 -28.64 61.92 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 121.617 1.544 . . . . 0.5 112.089 179.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.1 tppt? -72.77 -46.27 54.27 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.023 -0.535 . . . . 2.7799999999999998 111.185 -179.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 35.5 m -72.19 -25.23 23.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 C-N-CA 120.924 -0.311 . . . . 0.39000000000000001 110.521 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.01 -49.2 62.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 0.32000000000000001 110.494 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -68.91 -33.87 74.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.986 -0.552 . . . . 1.3999999999999999 110.098 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.521 ' SD ' ' HB3' ' A' ' 8' ' ' PHE . 39.2 ttm -66.41 -40.05 89.34 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.935 -0.575 . . . . 1.51 109.916 179.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 51.5 t90 -62.48 -47.33 84.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.493 -0.776 . . . . 0.40999999999999998 109.566 178.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 38.9 tttt -56.62 -47.71 79.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.384 -0.826 . . . . 1.1100000000000001 110.802 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.579 ' O ' ' HG2' ' A' ' 49' ' ' ARG . 12.4 mm-40 -57.95 -44.68 87.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.044 -0.526 . . . . 1.96 111.304 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -66.18 -44.46 83.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 1.5800000000000001 111.353 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 84.8 mmm -66.32 -29.62 69.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.303 -0.408 . . . . 0.69999999999999996 111.577 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.2 mt -92.73 19.4 7.55 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.796 0.331 . . . . 0.88 111.365 -179.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.579 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 36.1 mmt-85 -87.08 133.88 38.04 Favored Pre-proline 0 C--N 1.328 -0.353 0 N-CA-C 110.011 -0.366 . . . . 2.6899999999999999 110.011 178.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -74.34 -22.34 16.47 Favored 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.51 2.14 . . . . 0.93999999999999995 112.397 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.3 m -83.3 -16.18 47.23 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.244 -0.435 . . . . 1.3300000000000001 111.456 -179.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.6 t -77.76 127.36 38.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.122 0.486 . . . . 0.58999999999999997 110.794 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -66.55 149.13 50.91 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.437 -0.801 . . . . 1.8 111.137 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.48 -39.46 70.43 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.097 0.406 . . . . 0.81000000000000005 112.097 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 42.0 mtm105 -67.82 -29.73 68.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.877 0.37 . . . . 3.5800000000000001 110.682 -179.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -69.3 -36.67 77.26 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.642 -0.503 . . . . 3.0499999999999998 109.642 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 50.8 mttt -70.03 -33.15 71.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.695 -0.684 . . . . 0.58999999999999997 109.291 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 19.9 tp -62.66 -41.01 98.83 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.667 -0.697 . . . . 1.26 109.811 178.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.9 mp -67.64 -36.99 81.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.468 -0.787 . . . . 1.54 109.997 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.17 -30.19 75.36 Favored Glycine 0 C--N 1.331 0.293 0 CA-C-N 115.802 -0.635 . . . . 0.37 111.604 179.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 8.3 mt -63.84 -44.63 92.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.882 0.372 . . . . 1.23 110.216 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -62.56 -39.22 92.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.672 -0.695 . . . . 1.3799999999999999 110.548 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -61.25 -48.87 79.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.94 -0.573 . . . . 1.45 110.618 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.401 ' O ' HG12 ' A' ' 67' ' ' VAL . 14.7 tmm? -62.38 -48.56 79.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 0.60999999999999999 110.295 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -58.5 -41.59 85.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.794 -0.639 . . . . 1.6899999999999999 111.382 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -68.03 -47.72 67.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.157 -0.474 . . . . 1.54 111.612 -179.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.401 HG12 ' O ' ' A' ' 64' ' ' MET . 8.2 p -64.28 -36.29 76.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 112.645 0.609 . . . . 1.3999999999999999 112.645 -177.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 64' ' ' MET . 35.7 m -78.27 -26.07 14.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 C-N-CA 120.726 -0.39 . . . . 0.42999999999999999 111.28 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -52.07 20.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.018 0.437 . . . . 2.02 109.848 179.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 26.6 mm100 -72.27 -15.21 61.91 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.058 -0.519 . . . . 2.1000000000000001 110.925 -179.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.79 -25.68 68.02 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.261 -0.427 . . . . 0.51000000000000001 110.56 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.507 ' HG2' ' NE2' ' A' ' 80' ' ' GLN . 19.5 mtpt -70.63 -21.04 62.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.335 -0.393 . . . . 2.0899999999999999 110.443 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.21 -43.69 31.44 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.967 -0.635 . . . . 0.66000000000000003 112.177 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -91.47 -0.85 57.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.742 0.306 . . . . 1.6200000000000001 110.616 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp 62.98 46.09 4.99 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.429 -0.805 . . . . 2.7000000000000002 111.132 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 31.9 mm -95.89 78.7 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.921 -0.582 . . . . 0.63 110.124 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.571 ' HA ' ' OE1' ' A' ' 80' ' ' GLN . 15.4 pt -68.51 -16.3 20.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.713 -0.676 . . . . 0.85999999999999999 110.295 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -61.48 -37.9 85.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.542 -0.754 . . . . 2.2200000000000002 110.541 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.43 ' O ' ' HB2' ' A' ' 83' ' ' PHE . 0.8 OUTLIER -72.42 -42.13 65.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.017 -0.538 . . . . 1.3400000000000001 111.173 -179.406 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.571 ' OE1' ' HA ' ' A' ' 77' ' ' ILE . 21.6 mt-30 -68.94 -27.47 65.77 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.081 -0.509 . . . . 1.3 111.511 -178.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.56 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 5.6 t70 -76.02 -49.21 18.23 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.97 0.415 . . . . 1.3200000000000001 110.125 178.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.7 p -67.64 -49.15 64.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.022 -0.535 . . . . 0.93999999999999995 111.516 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.43 ' HB2' ' O ' ' A' ' 79' ' ' PHE . 4.4 m-85 -71.36 -30.7 66.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.59 -0.277 . . . . 1.23 111.239 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.85 -52.03 54.93 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.107 -0.568 . . . . 0.34000000000000002 113.785 -179.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.56 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 10.0 ptpt -60.26 -36.67 78.32 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.072 0.397 . . . . 1.3100000000000001 112.072 -178.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.8 m -82.8 -28.01 8.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 C-N-CA 120.667 -0.413 . . . . 0.38 111.124 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 91' ' ' LEU . . . -62.14 -41.2 98.03 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.639 -0.255 . . . . 0.38 110.934 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.09 -33.9 69.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.028 0.442 . . . . 0.45000000000000001 111.125 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -83.39 -52.46 6.51 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.909 -0.587 . . . . 1.5600000000000001 110.873 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.508 ' O ' HG12 ' A' ' 94' ' ' ILE . 75.7 t -57.56 -50.83 75.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.093 -0.503 . . . . 0.34000000000000002 111.997 -178.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.414 ' HB2' ' O ' ' A' ' 87' ' ' ALA . 8.5 mp -61.52 -38.52 87.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.692 -0.231 . . . . 1.45 111.087 -178.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -70.88 -28.82 70.02 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.506 -0.854 . . . . 0.40999999999999998 112.005 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.535 ' O ' ' HG2' ' A' ' 96' ' ' GLN . 1.3 mmm-85 -78.02 -51.45 10.32 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.646 0.26 . . . . 3.46 111.063 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.508 HG12 ' O ' ' A' ' 90' ' ' VAL . 32.8 pt -70.78 -15.85 19.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.523 -0.308 . . . . 0.5 111.615 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -58.19 -34.16 70.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.018 0.437 . . . . 1.0 110.675 179.301 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.535 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 4.3 pt20 -96.56 1.74 51.64 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.155 -0.475 . . . . 1.1399999999999999 110.799 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -100.67 -31.23 11.32 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.15 0.5 . . . . 1.3300000000000001 109.965 179.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -81.67 131.76 56.82 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.518 -0.765 . . . . 1.3899999999999999 111.11 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -65.1 167.6 15.8 Favored 'Trans proline' 0 CA--C 1.529 0.271 0 C-N-CA 122.699 2.266 . . . . 1.47 111.724 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 13.3 mmm180 -47.82 -40.57 21.51 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.852 0.686 . . . . 4.8700000000000001 112.852 -179.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -71.53 -47.81 52.76 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.002 0.371 . . . . 2.5800000000000001 112.002 -179.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 30.7 mt -70.94 -39.59 72.54 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.857 0.317 . . . . 0.84999999999999998 111.857 -178.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . 0.405 ' HB2' ' HE3' ' A' ' 103' ' ' LYS . 15.3 ptmt -71.15 -17.73 62.54 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.766 -0.374 . . . . 2.3599999999999999 110.629 -179.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -67.22 -34.38 77.35 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.182 -1.044 . . . . 2.5699999999999998 108.182 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.42 ' O ' HG23 ' A' ' 109' ' ' VAL . 74.0 mmtt -76.49 -37.05 57.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.178 -0.919 . . . . 2.4399999999999999 109.064 178.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 35.4 tp -59.58 -37.58 78.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.549 -0.75 . . . . 1.27 109.974 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.556 ' O ' ' HB2' ' A' ' 111' ' ' ASN . 36.7 m -61.04 -37.48 82.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.619 -0.719 . . . . 1.1499999999999999 110.328 179.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.9 mtt180 -70.24 -38.19 75.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 3.6000000000000001 110.555 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.443 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 61.8 t -60.9 -57.2 13.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.039 -0.528 . . . . 1.25 110.719 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.445 ' HA ' HD12 ' A' ' 113' ' ' LEU . 10.8 p -65.18 -28.97 45.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.182 -0.463 . . . . 1.1100000000000001 111.054 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.556 ' HB2' ' O ' ' A' ' 107' ' ' SER . 56.0 t30 -60.33 -55.71 30.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.248 -0.433 . . . . 1.74 110.307 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 95.7 mt -62.95 -36.19 74.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.092 -0.504 . . . . 1.21 111.154 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.445 HD12 ' HA ' ' A' ' 110' ' ' VAL . 71.5 mt -56.36 -42.8 78.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.363 -0.38 . . . . 1.3300000000000001 111.764 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.78 -29.32 19.86 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.816 -0.353 . . . . 1.6899999999999999 111.372 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -65.57 -38.55 89.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.764 0.316 . . . . 2.2000000000000002 111.561 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 7.9 mmm180 -96.11 5.61 50.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.347 -0.388 . . . . 3.23 111.012 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.0 m120 52.22 57.75 6.13 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.391 0.615 . . . . 2.0 110.901 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 43.2 mm -76.13 -33.63 24.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.552 -0.749 . . . . 0.60999999999999999 110.286 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' PHE . . . . . 0.432 ' HE2' HD13 ' A' ' 113' ' ' LEU . 80.5 m-85 -110.47 171.91 7.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.776 -0.647 . . . . 1.26 110.811 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.0 t -69.65 146.98 51.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.744 -0.662 . . . . 1.3 109.932 179.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 50.7 pttt -59.47 -27.48 66.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.759 0.281 . . . . 2.8500000000000001 111.759 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -68.78 -44.23 74.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.842 0.353 . . . . 2.9500000000000002 110.817 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.54 ' O ' HG13 ' A' ' 127' ' ' ILE . 9.1 p -82.47 -28.42 8.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.416 -0.356 . . . . 1.28 110.912 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 7.3 t -61.26 -43.22 96.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 109.633 -0.506 . . . . 1.23 109.633 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -64.7 -35.43 81.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.674 -0.694 . . . . 1.74 109.963 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -63.57 -41.26 98.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.872 -0.604 . . . . 1.4399999999999999 110.219 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . 0.54 HG13 ' O ' ' A' ' 123' ' ' VAL . 63.6 mt -62.73 -53.99 39.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.799 -0.637 . . . . 0.46999999999999997 111.334 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -63.55 -36.54 84.12 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 120.994 -0.282 . . . . 2.0499999999999998 111.08 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -61.98 -39.74 93.22 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.847 -0.427 . . . . 3.98 109.847 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 44.6 m -67.53 -39.77 85.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.916 -0.583 . . . . 0.69999999999999996 110.493 179.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.0 mt -69.16 -29.45 67.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.094 -0.503 . . . . 1.3300000000000001 110.927 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -78.78 -37.79 40.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.197 -0.456 . . . . 0.68999999999999995 110.503 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.02 -19.26 62.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.829 -0.623 . . . . 0.83999999999999997 111.782 -179.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.432 -0.349 . . . . 1.1200000000000001 111.072 -179.85 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 . . . . . 0 CA--C 1.531 0.22 0 CA-C-O 120.926 0.393 . . . . 2.75 111.724 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -68.54 -42.56 78.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.05 0.452 . . . . 0.91000000000000003 111.206 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.92 -42.49 94.04 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.964 0.727 . . . . 0.85999999999999999 112.964 -178.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.11 -21.92 61.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.61 0.243 . . . . 1.4199999999999999 111.385 -179.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -69.49 -36.74 76.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.74 0.305 . . . . 1.3 110.42 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -64.97 -28.88 69.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.236 0.541 . . . . 1.5700000000000001 110.708 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -78.9 -10.59 59.86 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.673 -0.694 . . . . 1.5900000000000001 110.919 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.59 36.28 4.64 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.171 0.51 . . . . 1.6299999999999999 111.155 -179.529 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 15' ' ' LEU . 13.9 mt -112.36 163.2 14.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.051 0.453 . . . . 1.1000000000000001 111.286 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -134.06 160.77 36.76 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.571 -0.74 . . . . 2.1600000000000001 109.133 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -79.82 29.31 0.26 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.777 0.323 . . . . 1.9399999999999999 111.701 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.535 ' HB2' ' OG ' ' A' ' 21' ' ' SER . 68.6 m -93.32 140.95 28.99 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.179 -0.304 . . . . 1.6100000000000001 110.179 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.49 -52.86 63.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.121 -0.491 . . . . 2.6400000000000001 110.333 -179.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -61.48 -40.77 95.76 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.908 -0.587 . . . . 2.9900000000000002 111.775 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.535 ' OG ' ' HB2' ' A' ' 18' ' ' SER . 18.1 m -59.25 -49.1 79.13 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.765 0.316 . . . . 1.1000000000000001 110.968 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.1 mm -64.1 -41.91 93.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.726 -0.472 . . . . 0.88 109.726 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.6 m -59.04 -40.88 86.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.928 -0.578 . . . . 1.1799999999999999 111.01 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.3 m -61.26 -47.16 87.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 1.1599999999999999 110.825 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.38 -42.0 79.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.347 -0.388 . . . . 0.45000000000000001 111.052 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 19.1 m -62.7 -36.64 83.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.28 -0.418 . . . . 1.3200000000000001 111.244 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.9 ttpt -61.24 -40.91 95.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.811 0.339 . . . . 2.3799999999999999 110.532 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 33.1 t90 -68.59 -38.24 80.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.955 0.407 . . . . 0.97999999999999998 109.916 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -64.12 -41.06 97.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.796 -0.638 . . . . 1.3 110.756 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.66 -33.24 73.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.119 -0.491 . . . . 1.0600000000000001 110.732 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 74.8 mt -73.04 -25.18 60.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.968 -0.56 . . . . 1.71 110.308 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 70.9 mm-40 -97.93 48.42 1.01 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.044 -0.525 . . . . 1.51 110.613 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.452 ' HA ' ' CZ ' ' A' ' 79' ' ' PHE . 6.6 p90 -59.71 -21.31 60.44 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.681 -0.69 . . . . 1.6100000000000001 111.614 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -75.64 -14.77 60.38 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.28 -0.418 . . . . 3.9700000000000002 111.363 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -109.44 12.72 24.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.778 0.323 . . . . 1.7 110.899 -179.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.463 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -51.45 -51.02 73.17 Favored Pre-proline 0 CA--C 1.538 0.483 0 CA-C-N 115.903 -0.59 . . . . 0.42999999999999999 112.414 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 39.3 Cg_endo -66.07 -19.92 57.19 Favored 'Trans proline' 0 C--N 1.357 0.978 0 C-N-CA 121.888 1.725 . . . . 0.5 112.831 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.7 tptm -88.28 -46.26 9.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.672 0.272 . . . . 2.7799999999999998 110.821 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.2 m -67.44 -28.36 41.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.964 -0.294 . . . . 0.39000000000000001 110.854 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.98 -46.77 80.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.362 -0.381 . . . . 0.32000000000000001 111.337 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -70.41 -38.09 74.56 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.891 -0.324 . . . . 1.3999999999999999 110.454 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 68.8 mtm -63.12 -41.91 99.42 Favored 'General case' 0 CA--C 1.521 -0.168 0 N-CA-C 109.98 -0.378 . . . . 1.51 109.98 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 71.1 t90 -61.95 -48.57 79.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.616 -0.72 . . . . 0.40999999999999998 110.256 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.509 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 16.1 ttpt -58.71 -49.51 77.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.807 -0.633 . . . . 1.1100000000000001 110.65 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.486 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 57.7 mm-40 -60.85 -42.3 97.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.886 -0.597 . . . . 1.96 111.087 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 76.3 t80 -62.65 -47.7 82.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.104 -0.498 . . . . 1.5800000000000001 111.109 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 74.6 mmm -64.55 -20.8 66.45 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.26 -0.427 . . . . 0.69999999999999996 111.988 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 64.0 mt -97.63 0.12 46.67 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.626 0.232 . . . . 0.88 111.626 -179.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.486 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 27.0 mtp180 -79.03 135.64 58.42 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.628 0.251 . . . . 2.6899999999999999 110.528 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.12 5.95 3.28 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.909 2.406 . . . . 0.93999999999999995 112.81 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.1 m -103.22 8.23 38.46 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.097 -0.501 . . . . 1.3300000000000001 110.347 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.5 t -111.54 123.6 67.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.984 -0.553 . . . . 0.58999999999999997 111.065 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -73.3 153.7 40.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.0 -0.545 . . . . 1.8 110.641 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.09 -32.56 62.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 0.81000000000000005 112.193 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -42.37 98.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.875 0.369 . . . . 3.5800000000000001 110.79 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.9 mtm-85 -71.57 -29.8 65.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.246 -0.434 . . . . 3.0499999999999998 110.617 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 54.2 mttt -65.28 -34.43 78.33 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.334 -0.617 . . . . 0.58999999999999997 109.334 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 21.4 tp -67.53 -41.25 84.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.803 -0.635 . . . . 1.26 109.315 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.7 mp -63.75 -44.83 92.32 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.291 -0.868 . . . . 1.54 110.032 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.16 -35.39 91.46 Favored Glycine 0 C--N 1.333 0.383 0 CA-C-N 115.845 -0.616 . . . . 0.37 111.949 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.36 -44.31 91.82 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.666 -0.494 . . . . 1.23 109.666 179.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -65.81 -34.47 78.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.801 -0.636 . . . . 1.3799999999999999 111.114 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 39.3 tp -63.84 -44.14 94.07 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.76 -0.459 . . . . 1.45 109.76 178.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.449 ' O ' HG22 ' A' ' 68' ' ' VAL . 15.8 tmm? -64.97 -44.32 89.77 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.688 -0.687 . . . . 0.60999999999999999 109.897 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -57.67 -39.7 77.68 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.817 -0.628 . . . . 1.6899999999999999 110.999 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -67.04 -52.73 38.62 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.081 -0.509 . . . . 1.54 111.44 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 31.5 m -63.18 -34.89 69.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 112.817 0.673 . . . . 1.3999999999999999 112.817 -178.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.449 HG22 ' O ' ' A' ' 64' ' ' MET . 34.6 m -78.5 -24.77 13.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 C-N-CA 120.276 -0.57 . . . . 0.42999999999999999 110.969 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -76.74 -45.81 27.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.155 0.502 . . . . 2.02 109.953 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -75.29 -16.36 60.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.617 -0.719 . . . . 2.1000000000000001 110.819 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.47 -33.99 73.38 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 116.06 -0.518 . . . . 0.51000000000000001 110.682 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.555 ' HG2' HE22 ' A' ' 80' ' ' GLN . 1.8 mmtp -68.35 -27.32 66.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 2.0899999999999999 110.347 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.01 -46.37 73.77 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.932 -0.576 . . . . 0.66000000000000003 111.801 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -87.38 -6.56 58.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.981 0.42 . . . . 1.6200000000000001 110.352 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.88 27.17 9.09 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.25 -0.886 . . . . 2.7000000000000002 111.668 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.7 mm -94.44 87.71 2.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 109.343 -0.614 . . . . 0.63 109.343 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 18.2 pt -72.33 -8.8 12.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.901 -0.59 . . . . 0.85999999999999999 111.796 -178.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -60.16 -33.38 72.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.918 0.389 . . . . 2.2200000000000002 110.388 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.452 ' CZ ' ' HA ' ' A' ' 33' ' ' TYR . 29.7 m-85 -69.04 -48.72 62.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.873 -0.603 . . . . 1.3400000000000001 109.615 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.555 HE22 ' HG2' ' A' ' 72' ' ' LYS . 86.0 mt-30 -65.19 -32.13 73.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.301 -0.863 . . . . 1.3 111.553 -179.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.501 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 9.5 t70 -72.74 -53.64 11.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.834 0.349 . . . . 1.3200000000000001 110.406 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.4 m -63.65 -42.58 98.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.062 -0.517 . . . . 0.93999999999999995 111.774 -179.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -78.35 -29.19 47.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.616 -0.265 . . . . 1.23 110.977 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -64.95 -41.65 97.26 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 121.049 -0.596 . . . . 0.34000000000000002 113.346 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.501 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 12.8 ptpt -68.82 -18.34 64.15 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.042 0.386 . . . . 1.3100000000000001 112.042 -178.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 32.6 m -107.95 -19.91 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 121.008 -0.277 . . . . 0.38 111.222 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.13 95.6 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.431 -0.35 . . . . 0.38 110.96 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.73 -44.2 73.33 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.077 -0.511 . . . . 0.45000000000000001 110.624 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.411 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 35.4 tp10 -63.68 -58.72 6.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.601 -0.727 . . . . 1.5600000000000001 110.208 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.485 ' O ' HG12 ' A' ' 94' ' ' ILE . 80.7 t -54.03 -50.27 55.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.761 -0.654 . . . . 0.34000000000000002 111.994 -179.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 81.7 mt -60.97 -42.5 98.42 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.641 0.237 . . . . 1.45 111.641 -179.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -67.86 -25.02 74.33 Favored Glycine 0 CA--C 1.519 0.318 0 C-N-CA 120.718 -0.753 . . . . 0.40999999999999998 112.241 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.411 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 33.5 mmm-85 -83.31 -55.05 4.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.641 0.258 . . . . 3.46 111.213 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.485 HG12 ' O ' ' A' ' 90' ' ' VAL . 30.6 pt -66.38 -19.8 26.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 112.359 0.503 . . . . 0.5 112.359 -178.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.1 t30 -63.45 -24.27 67.76 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.256 0.551 . . . . 1.0 110.31 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -90.74 -14.1 32.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.058 -0.519 . . . . 1.1399999999999999 110.73 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -101.91 -28.69 12.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.03 -0.532 . . . . 1.3300000000000001 111.048 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -70.26 121.76 84.21 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.166 -0.47 . . . . 1.3899999999999999 111.411 -179.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -68.64 175.91 6.54 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.417 2.078 . . . . 1.47 111.822 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 13.5 ptt-85 -53.02 -27.67 20.53 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.052 -0.522 . . . . 4.8700000000000001 112.106 -179.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -76.37 -48.42 19.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.028 0.442 . . . . 2.5800000000000001 111.776 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 22.3 mt -76.7 -35.36 57.93 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.737 0.643 . . . . 0.84999999999999998 112.737 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 6.0 pttp -64.89 -25.22 67.8 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.733 -0.387 . . . . 2.3599999999999999 110.993 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' A' ' 100' ' ' ARG . 47.6 mtmt -66.31 -37.74 86.08 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.221 -0.659 . . . . 2.5699999999999998 109.221 178.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -75.68 -34.26 60.42 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.162 -0.926 . . . . 2.4399999999999999 109.798 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 7.0 tt -63.79 -41.99 97.82 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.417 -0.81 . . . . 1.27 109.985 178.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 21.0 m -62.58 -32.5 73.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.126 -0.488 . . . . 1.1499999999999999 110.611 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 70.6 mtt180 -67.17 -55.43 14.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.028 -0.533 . . . . 3.6000000000000001 111.286 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 7.7 p -62.48 -42.5 95.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.307 -0.406 . . . . 1.25 111.983 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.72 -40.56 82.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 120.836 0.35 . . . . 1.1100000000000001 110.555 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.458 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 11.9 t-20 -61.28 -48.56 80.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.867 -0.606 . . . . 1.74 110.637 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 63.3 mt -61.12 -46.71 96.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.281 -0.418 . . . . 1.21 111.347 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 96.3 mt -59.12 -42.49 90.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.094 -0.503 . . . . 1.3300000000000001 112.291 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 111' ' ' ASN . 1.2 ptpt -78.48 -33.31 48.31 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.054 0.39 . . . . 1.6899999999999999 112.054 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -75.62 -39.2 58.19 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.906 0.336 . . . . 2.2000000000000002 111.906 -178.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -79.96 -1.15 38.24 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.033 0.444 . . . . 3.23 110.801 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 60.8 50.76 5.18 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.589 -0.732 . . . . 2.0 111.454 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 45.9 mm -72.47 -40.6 63.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.091 0.472 . . . . 0.60999999999999999 110.235 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -109.52 173.85 6.13 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.938 -0.574 . . . . 1.26 109.835 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.78 162.69 29.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.175 -0.466 . . . . 1.3 110.863 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 15.2 mmmt -52.74 -50.27 63.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.17 -0.468 . . . . 2.8500000000000001 111.292 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -56.37 -34.45 66.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.843 -0.617 . . . . 2.9500000000000002 112.072 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 61.6 t -80.14 -49.58 18.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.793 0.294 . . . . 1.28 111.793 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 34.7 m -62.63 -29.74 47.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 C-N-CA 120.964 -0.294 . . . . 1.23 111.159 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -78.92 -27.16 43.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.931 0.395 . . . . 1.74 110.819 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.48 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 44.8 t0 -76.63 -41.25 46.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.267 0.556 . . . . 1.4399999999999999 109.959 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 96.3 mt -60.08 -50.97 78.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.826 -0.624 . . . . 0.46999999999999997 111.42 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -65.65 -37.39 86.41 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.123 0.416 . . . . 2.0499999999999998 112.123 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.48 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 33.2 ptt180 -69.63 -26.03 64.22 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 120.761 -0.376 . . . . 3.98 110.785 -179.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 49.3 m -68.36 -39.18 81.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.294 0.568 . . . . 0.69999999999999996 109.684 178.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.8 mp -67.39 -41.93 84.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.735 -0.666 . . . . 1.3300000000000001 110.123 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.06 -34.9 77.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.795 -0.638 . . . . 0.68999999999999995 111.043 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -73.14 -25.08 60.69 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.825 0.345 . . . . 0.83999999999999997 111.086 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.403 0 CA-C-N 116.513 -0.312 . . . . 1.1200000000000001 110.992 179.769 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.587 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 48.8 mt-30 . . . . . 0 N--CA 1.458 -0.062 0 CA-C-O 120.875 0.369 . . . . 2.75 110.08 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.574 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 70.3 t80 -59.11 -48.97 79.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.73 -0.668 . . . . 0.91000000000000003 110.508 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.0 -39.08 88.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.889 -0.596 . . . . 0.85999999999999999 111.039 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -64.99 -32.49 74.24 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 115.889 -0.596 . . . . 1.4199999999999999 111.197 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 27.6 mmmt -76.49 -40.72 49.45 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 121.065 -0.254 . . . . 1.3 110.589 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.15 -39.78 91.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.067 -0.515 . . . . 1.5700000000000001 111.381 -179.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -76.11 -1.96 28.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.425 -0.352 . . . . 1.5900000000000001 111.599 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.7 m -126.93 32.39 5.12 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.586 0.708 . . . . 1.6299999999999999 110.155 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 15' ' ' LEU . 14.6 mt -111.75 168.1 9.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.683 -0.69 . . . . 1.1000000000000001 111.162 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.541 ' HG2' ' H ' ' A' ' 17' ' ' ASP . 11.1 tt0 -137.9 173.72 11.33 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.551 -0.907 . . . . 2.1600000000000001 108.551 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.541 ' H ' ' HG2' ' A' ' 16' ' ' GLU . 4.6 p30 -79.78 16.43 1.14 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.768 0.318 . . . . 1.9399999999999999 111.665 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.413 ' O ' HG12 ' A' ' 22' ' ' ILE . 0.0 OUTLIER -82.07 132.67 35.25 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.832 -0.433 . . . . 1.6100000000000001 109.832 178.885 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.45 ' HG2' ' N ' ' A' ' 20' ' ' GLU . 16.5 pm0 -62.94 -39.21 93.93 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.019 0.377 . . . . 2.6400000000000001 112.019 -178.33 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.45 ' N ' ' HG2' ' A' ' 19' ' ' GLN . 5.9 tp10 -71.31 -25.62 62.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.995 0.426 . . . . 2.9900000000000002 110.152 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 66.8 m -71.21 -44.32 65.63 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.9 -0.778 . . . . 1.1000000000000001 108.9 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 18' ' ' SER . 47.2 mm -65.29 -45.09 94.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 108.69 -0.856 . . . . 0.88 108.69 178.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.8 t -54.86 -43.81 73.42 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.208 -0.905 . . . . 1.1799999999999999 110.884 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.8 t -58.45 -43.51 88.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 1.1599999999999999 110.857 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.9 -45.15 59.78 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.266 -0.424 . . . . 0.45000000000000001 110.989 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 34.4 m -59.8 -40.65 89.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.325 -0.398 . . . . 1.3200000000000001 111.306 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.57 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 8.2 mptt -56.97 -43.97 82.15 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.085 0.469 . . . . 2.3799999999999999 110.273 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 24.2 t90 -68.93 -36.68 78.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.674 -0.694 . . . . 0.97999999999999998 110.454 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -66.85 -43.64 83.1 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.193 -0.458 . . . . 1.3 110.91 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.4 mt -60.3 -27.41 67.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.071 -0.513 . . . . 1.0600000000000001 111.793 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 77.8 mt -68.37 -39.09 81.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.934 0.397 . . . . 1.71 111.109 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.423 ' H ' ' HG2' ' A' ' 32' ' ' GLN . 9.5 pt20 -95.28 56.77 1.92 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.454 0.645 . . . . 1.51 110.716 -179.617 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.408 ' HA ' ' CE2' ' A' ' 79' ' ' PHE . 36.5 p90 -64.51 -17.24 63.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.476 -0.784 . . . . 1.6100000000000001 111.557 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 34' ' ' ARG . 9.3 ttp180 -79.9 -3.7 49.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.831 0.348 . . . . 3.9700000000000002 111.229 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.45 22.18 12.23 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.073 0.463 . . . . 1.7 110.05 179.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.459 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.05 -51.75 68.39 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.253 -0.885 . . . . 0.42999999999999999 112.274 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.46 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 24.1 Cg_endo -62.77 -33.06 77.58 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 121.721 1.614 . . . . 0.5 112.521 179.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -46.73 72.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.334 -0.394 . . . . 2.7799999999999998 111.059 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.2 m -74.56 -25.72 19.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.684 -0.406 . . . . 0.39000000000000001 110.728 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.05 -49.99 65.74 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.359 -0.382 . . . . 0.32000000000000001 110.769 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 4.1 pt-20 -66.71 -35.94 81.31 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.328 -0.396 . . . . 1.3999999999999999 110.258 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.574 ' SD ' ' HB3' ' A' ' 8' ' ' PHE . 16.3 ttm -65.18 -40.67 94.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.095 -0.502 . . . . 1.51 109.946 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 67.4 t90 -63.78 -48.03 78.53 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.793 -0.64 . . . . 0.40999999999999998 109.645 178.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.8 ttpt -59.75 -46.89 87.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.785 -0.643 . . . . 1.1100000000000001 110.396 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.548 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 0.8 OUTLIER -59.72 -47.14 86.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.989 -0.55 . . . . 1.96 110.526 179.798 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -61.37 -49.64 76.11 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.714 -0.675 . . . . 1.5800000000000001 111.549 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 89.0 mmm -63.4 -28.38 69.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.376 -0.374 . . . . 0.69999999999999996 111.937 -179.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 73.6 mt -97.89 22.48 9.2 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 111.648 0.24 . . . . 0.88 111.648 -179.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 11.2 mtp180 -101.18 139.22 20.28 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.722 0.296 . . . . 2.6899999999999999 110.689 179.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.26 -1.81 11.47 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 123.128 2.552 . . . . 0.93999999999999995 112.789 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.15 17.34 21.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.998 -0.546 . . . . 1.3300000000000001 110.751 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 24.2 t -123.32 114.8 43.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.082 -0.508 . . . . 0.58999999999999997 111.15 -179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -67.23 159.65 28.66 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.93 -0.577 . . . . 1.8 110.02 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.35 -37.9 73.3 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.54 0.57 . . . . 0.81000000000000005 112.54 -178.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -40.94 95.53 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.604 0.24 . . . . 3.5800000000000001 110.613 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.1 mtm-85 -70.56 -36.46 73.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.407 -0.36 . . . . 3.0499999999999998 110.465 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -65.37 -37.37 86.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.419 0.628 . . . . 0.58999999999999997 109.369 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 19.2 tp -64.08 -36.81 85.23 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.585 -0.734 . . . . 1.26 109.595 178.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.3 mp -68.21 -39.37 82.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.41 -0.814 . . . . 1.54 109.819 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.29 -32.95 85.9 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 111.452 -0.659 . . . . 0.37 111.452 179.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.431 HD21 HD21 ' A' ' 91' ' ' LEU . 0.4 OUTLIER -67.24 -40.19 86.29 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.431 -0.581 . . . . 1.23 109.431 178.643 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -60.35 -44.57 95.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.555 -0.748 . . . . 1.3799999999999999 110.264 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 12.4 tp -63.25 -43.9 96.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.004 -0.544 . . . . 1.45 110.701 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.439 ' O ' HG22 ' A' ' 68' ' ' VAL . 12.7 tmm? -59.86 -49.62 76.98 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.006 -0.543 . . . . 0.60999999999999999 110.392 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -59.25 -42.69 91.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.062 0.458 . . . . 1.6899999999999999 110.325 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 40.5 t-80 -61.99 -53.82 50.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.708 -0.678 . . . . 1.54 112.1 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 35.8 m -62.05 -37.45 78.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 N-CA-C 112.89 0.7 . . . . 1.3999999999999999 112.89 -177.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.439 HG22 ' O ' ' A' ' 64' ' ' MET . 33.0 m -79.06 -27.04 13.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 120.368 -0.533 . . . . 0.42999999999999999 111.44 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -72.12 -49.06 39.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.995 0.426 . . . . 2.02 109.854 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -71.44 -20.21 62.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.805 -0.634 . . . . 2.1000000000000001 110.614 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.1 -21.54 66.57 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.052 -0.522 . . . . 0.51000000000000001 111.201 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.416 ' HD3' HE22 ' A' ' 80' ' ' GLN . 1.0 OUTLIER -69.87 -31.47 69.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.775 0.322 . . . . 2.0899999999999999 110.298 179.43 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -75.89 -40.78 29.8 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.632 -0.794 . . . . 0.66000000000000003 111.232 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -79.52 -12.63 59.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.71 -0.245 . . . . 1.6200000000000001 110.555 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 41.1 mttp 65.27 34.07 8.67 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 123.658 0.599 . . . . 2.7000000000000002 110.93 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 27.0 mm -93.06 85.55 2.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.043 -0.526 . . . . 0.63 110.264 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 19.5 pt -69.95 -24.89 26.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.761 -0.654 . . . . 0.85999999999999999 110.999 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.83 -35.47 74.81 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.104 -0.498 . . . . 2.2200000000000002 110.713 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.408 ' CE2' ' HA ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -69.75 -49.13 56.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.249 -0.432 . . . . 1.3400000000000001 110.333 179.633 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.416 HE22 ' HD3' ' A' ' 72' ' ' LYS . 94.9 mt-30 -63.31 -35.64 81.04 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.482 -0.781 . . . . 1.3 111.027 -179.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.547 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 17.3 t70 -66.53 -51.11 60.19 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.081 0.467 . . . . 1.3200000000000001 110.544 179.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.8 m -63.24 -42.28 99.2 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.447 -0.797 . . . . 0.93999999999999995 111.84 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -77.87 -35.09 51.32 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.965 -0.294 . . . . 1.23 111.334 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.84 -40.89 98.87 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 121.393 -0.432 . . . . 0.34000000000000002 113.845 -178.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.547 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 14.3 ptpt -65.98 -24.27 66.75 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 117.148 0.474 . . . . 1.3100000000000001 112.234 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.2 m -105.1 -15.13 8.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 C-N-CA 120.914 -0.314 . . . . 0.38 111.022 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.73 -49.99 74.21 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.193 -0.458 . . . . 0.38 111.215 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.1 -41.61 75.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.496 . . . . 0.45000000000000001 111.04 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.555 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 4.8 tp10 -62.62 -60.07 4.03 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.753 -0.658 . . . . 1.5600000000000001 110.449 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.512 ' O ' HG12 ' A' ' 94' ' ' ILE . 72.6 t -56.45 -49.22 78.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.728 -0.669 . . . . 0.34000000000000002 111.835 -178.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.431 HD21 HD21 ' A' ' 61' ' ' LEU . 54.4 mt -58.63 -38.32 77.82 Favored 'General case' 0 C--N 1.331 -0.22 0 O-C-N 123.146 0.279 . . . . 1.45 111.532 -179.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -70.6 -28.89 70.3 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.703 -0.761 . . . . 0.40999999999999998 112.72 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.555 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 23.9 mmm-85 -83.44 -49.62 9.12 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 122.857 -0.202 . . . . 3.46 111.3 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.512 HG12 ' O ' ' A' ' 90' ' ' VAL . 20.8 pt -66.09 -20.37 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 N-CA-C 111.988 0.366 . . . . 0.5 111.988 -178.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -63.1 -28.16 69.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.333 0.587 . . . . 1.0 109.937 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -88.67 -13.21 40.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.724 -0.671 . . . . 1.1399999999999999 110.738 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -97.1 -38.03 9.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.968 -0.56 . . . . 1.3300000000000001 111.147 -179.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 14.0 m-30 -72.8 125.94 90.9 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 116.424 -0.353 . . . . 1.3899999999999999 110.932 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.48 177.44 3.96 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.554 2.169 . . . . 1.47 112.029 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 13.8 ptt-85 -52.61 -36.05 55.57 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 112.862 0.69 . . . . 4.8700000000000001 112.862 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . 0.481 ' HA ' ' HE2' ' A' ' 104' ' ' LYS . 1.3 m-20 -76.66 -25.28 53.55 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.741 0.645 . . . . 2.5800000000000001 112.741 -178.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 14.9 mt -93.37 -31.18 14.75 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.868 -0.333 . . . . 0.84999999999999998 110.972 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . 0.523 ' HA ' HD23 ' A' ' 106' ' ' LEU . 32.0 pttt -63.14 -31.61 72.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.456 -0.338 . . . . 2.3599999999999999 111.134 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.481 ' HE2' ' HA ' ' A' ' 101' ' ' ASP . 51.3 mtmt -64.43 -37.92 89.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.053 0.454 . . . . 2.5699999999999998 110.302 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.6 mttm -70.46 -40.97 73.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.843 -0.617 . . . . 2.4399999999999999 109.852 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.523 HD23 ' HA ' ' A' ' 103' ' ' LYS . 0.1 OUTLIER -65.31 -35.91 82.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.955 -0.566 . . . . 1.27 109.728 178.877 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 65.1 m -62.89 -37.18 85.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.185 -0.461 . . . . 1.1499999999999999 110.362 178.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 39.1 mtt180 -65.05 -36.52 84.6 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 109.847 -0.427 . . . . 3.6000000000000001 109.847 179.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 49.1 t -67.37 -49.76 68.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.991 -0.55 . . . . 1.25 110.013 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 71.0 t -59.16 -37.1 66.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.208 0.527 . . . . 1.1100000000000001 110.043 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -60.12 -59.61 5.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.342 -0.844 . . . . 1.74 111.06 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.7 tt -61.41 -34.31 60.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 N-CA-C 111.847 0.314 . . . . 1.21 111.847 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 73.6 mt -63.09 -49.98 72.32 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.931 0.345 . . . . 1.3300000000000001 111.931 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.6 ptpt -82.56 -29.1 30.54 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.07 0.396 . . . . 1.6899999999999999 112.07 -178.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -67.18 -41.9 85.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.715 0.293 . . . . 2.2000000000000002 110.908 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -90.8 3.69 53.72 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.529 -0.305 . . . . 3.23 110.523 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 51.27 59.28 4.71 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.618 -0.719 . . . . 2.0 111.059 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 46.6 mm -73.89 -38.75 50.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.677 -0.692 . . . . 0.60999999999999999 109.888 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -107.15 169.52 8.51 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.691 -0.686 . . . . 1.26 109.569 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.52 157.67 19.83 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 123.27 0.356 . . . . 1.3 110.517 179.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.405 ' HA ' HG22 ' A' ' 124' ' ' VAL . 0.0 OUTLIER -57.25 -35.39 69.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.506 -0.315 . . . . 2.8500000000000001 111.429 -178.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -68.11 -37.01 80.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.826 0.346 . . . . 2.9500000000000002 110.764 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 58.5 t -70.46 -47.11 67.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.326 -0.397 . . . . 1.28 110.88 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.405 HG22 ' HA ' ' A' ' 121' ' ' LYS . 27.5 m -66.21 -24.31 33.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.982 0.42 . . . . 1.23 110.43 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.27 -20.57 47.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.879 -0.601 . . . . 1.74 110.241 179.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.504 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 20.3 t0 -83.87 -39.57 19.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.421 0.629 . . . . 1.4399999999999999 109.721 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 63.1 mt -61.93 -46.5 96.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.701 -0.681 . . . . 0.46999999999999997 110.91 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -66.36 -37.85 86.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.431 -0.35 . . . . 2.0499999999999998 111.764 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 30.5 ptt180 -68.93 -39.57 79.53 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.84 -0.344 . . . . 3.98 110.741 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 48.7 m -70.24 -35.37 73.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.948 0.404 . . . . 0.69999999999999996 110.794 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.9 -45.6 81.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.181 -0.463 . . . . 1.3300000000000001 110.266 179.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.83 -39.15 69.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.726 -0.67 . . . . 0.68999999999999995 111.535 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.27 -31.68 72.3 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.82 0.343 . . . . 0.83999999999999997 111.498 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.098 -0.501 . . . . 1.1200000000000001 111.589 -179.869 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 . . . . . 0 C--O 1.226 -0.151 0 CA-C-O 121.074 0.464 . . . . 2.75 110.874 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -91.37 -38.05 12.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.961 -0.563 . . . . 0.91000000000000003 110.634 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.84 -44.26 94.16 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.731 -0.668 . . . . 0.85999999999999999 112.487 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 4.5 t -68.33 -26.85 65.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.645 0.259 . . . . 1.4199999999999999 111.236 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.516 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 29.8 mmmt -68.8 -36.15 77.9 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 120.805 0.336 . . . . 1.3 110.146 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 42.9 mt -67.54 -34.84 77.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.913 -0.585 . . . . 1.5700000000000001 110.669 179.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 -70.12 -31.28 68.74 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.75 -0.659 . . . . 1.5900000000000001 111.621 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.5 t -104.09 16.52 26.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.751 0.31 . . . . 1.6299999999999999 111.81 -179.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 8.1 mt -73.73 176.4 6.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.101 0.477 . . . . 1.1000000000000001 111.342 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.46 ' HG2' ' H ' ' A' ' 17' ' ' ASP . 5.6 tt0 -146.25 168.8 20.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.715 -0.675 . . . . 2.1600000000000001 109.552 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.46 ' H ' ' HG2' ' A' ' 16' ' ' GLU . 5.2 p-10 -84.16 10.26 10.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.193 0.521 . . . . 1.9399999999999999 110.089 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.471 ' O ' HG12 ' A' ' 22' ' ' ILE . 1.4 t -77.16 129.04 35.45 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.509 -0.769 . . . . 1.6100000000000001 110.53 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -65.34 -33.2 75.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.494 0.664 . . . . 2.6400000000000001 109.841 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -66.93 -46.43 74.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.986 -1.006 . . . . 2.9900000000000002 111.096 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.6 p -69.14 -39.48 78.83 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 121.071 -0.252 . . . . 1.1000000000000001 111.46 -179.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 18' ' ' SER . 39.7 mm -59.25 -45.24 93.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 120.765 0.317 . . . . 0.88 110.383 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 t -63.97 -29.91 71.03 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.175 -0.466 . . . . 1.1799999999999999 110.531 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.0 m -68.62 -31.12 70.06 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.134 -0.485 . . . . 1.1599999999999999 110.399 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.15 -44.88 28.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.921 -0.582 . . . . 0.45000000000000001 110.681 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.7 p -64.96 -33.18 75.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.313 -0.403 . . . . 1.3200000000000001 110.673 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.438 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -63.1 -33.15 74.83 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.256 -0.429 . . . . 2.3799999999999999 110.734 179.374 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 17.4 t90 -79.87 -34.51 39.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.05 0.452 . . . . 0.97999999999999998 109.946 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.1 mp -63.78 -41.23 97.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.989 -0.55 . . . . 1.3 110.923 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.478 HD12 HE21 ' A' ' 70' ' ' GLN . 17.0 mt -64.59 -21.08 66.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.459 -0.337 . . . . 1.0600000000000001 111.803 -179.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 79.1 mt -76.24 -32.23 58.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.837 0.351 . . . . 1.71 110.634 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -105.19 59.8 0.68 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.671 0.748 . . . . 1.51 109.791 179.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 28.1 p90 -60.85 -21.34 63.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.137 -0.938 . . . . 1.6100000000000001 111.831 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 66.7 mtt180 -77.86 -12.35 59.97 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.075 0.464 . . . . 3.9700000000000002 110.506 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.34 7.09 44.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.044 -0.525 . . . . 1.7 110.492 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.466 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -51.31 -52.57 58.02 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-N 115.518 -0.765 . . . . 0.42999999999999999 112.316 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 21.7 Cg_endo -61.76 -31.71 85.93 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 121.853 1.702 . . . . 0.5 112.227 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 42' ' ' MET . 47.3 mtpt -73.17 -51.08 19.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.942 -0.572 . . . . 2.7799999999999998 111.174 -179.205 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 28.0 m -67.96 -27.07 36.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 120.998 -0.281 . . . . 0.39000000000000001 110.931 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.32 -51.44 60.61 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.934 0.397 . . . . 0.32000000000000001 110.527 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -70.06 -34.94 73.84 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.382 -0.372 . . . . 1.3999999999999999 110.12 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.429 ' HB2' ' O ' ' A' ' 38' ' ' LYS . 14.4 ttm -61.96 -42.22 98.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.972 -0.558 . . . . 1.51 109.655 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 53.4 t90 -63.35 -49.95 71.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.228 -0.896 . . . . 0.40999999999999998 110.191 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.512 ' HE2' HD12 ' A' ' 48' ' ' LEU . 11.9 tmtt? -58.16 -46.51 85.58 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.764 -0.653 . . . . 1.1100000000000001 110.949 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.506 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 64.7 mm-40 -61.54 -47.35 85.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.029 -0.532 . . . . 1.96 111.7 -179.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -65.39 -45.7 82.95 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.177 -0.465 . . . . 1.5800000000000001 111.152 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 72.9 mmm -63.4 -28.39 69.95 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.196 0.443 . . . . 0.69999999999999996 112.196 -178.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.512 HD12 ' HE2' ' A' ' 44' ' ' LYS . 15.4 mt -97.26 14.99 24.1 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 111.927 0.343 . . . . 0.88 111.927 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.506 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 79.5 mtt180 -89.29 139.76 28.56 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 110.301 -0.259 . . . . 2.6899999999999999 110.301 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.08 -18.32 27.49 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.942 2.428 . . . . 0.93999999999999995 112.685 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.23 -7.15 56.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.211 0.529 . . . . 1.3300000000000001 111.252 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.2 t -97.81 125.27 51.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.034 -0.53 . . . . 0.58999999999999997 110.853 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -74.49 152.71 39.36 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.695 -0.684 . . . . 1.8 110.015 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -34.64 64.07 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.12 0.415 . . . . 0.81000000000000005 112.12 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.59 -34.47 78.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.845 0.355 . . . . 3.5800000000000001 110.671 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.4 mmt-85 -74.4 -33.47 63.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.381 -0.372 . . . . 3.0499999999999998 110.299 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 57.4 mttt -65.44 -32.28 73.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.08 -0.509 . . . . 0.58999999999999997 109.956 179.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 75.3 mt -63.94 -43.13 96.8 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.397 -0.594 . . . . 1.26 109.397 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.5 mp -64.78 -41.53 95.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.395 -0.82 . . . . 1.54 110.068 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.31 -36.6 93.41 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.884 -0.674 . . . . 0.37 111.458 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 49.1 tp -69.79 -36.14 75.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.998 0.428 . . . . 1.23 110.065 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 9.8 m-30 -61.59 -40.11 93.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.706 -0.679 . . . . 1.3799999999999999 110.648 179.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.75 -40.78 98.32 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.917 -0.583 . . . . 1.45 110.539 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.485 ' O ' HG22 ' A' ' 68' ' ' VAL . 13.4 tmm? -61.5 -51.39 68.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.357 -0.383 . . . . 0.60999999999999999 110.441 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.444 ' O ' ' HB2' ' A' ' 69' ' ' GLN . 13.5 t30 -58.92 -35.91 73.85 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.968 0.413 . . . . 1.6899999999999999 111.086 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.469 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 1.9 t-80 -74.84 -50.42 17.14 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.302 -0.408 . . . . 1.54 111.804 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 9.9 p -60.18 -39.28 80.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 112.092 0.404 . . . . 1.3999999999999999 112.092 -178.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.485 HG22 ' O ' ' A' ' 64' ' ' MET . 33.6 m -75.01 -24.18 17.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 120.769 -0.372 . . . . 0.42999999999999999 111.03 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.444 ' HB2' ' O ' ' A' ' 65' ' ' ASN . 3.0 tp-100 -67.91 -49.53 61.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.111 0.481 . . . . 2.02 110.151 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.478 HE21 HD12 ' A' ' 30' ' ' LEU . 9.2 pt20 -82.89 -14.95 53.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.793 -0.64 . . . . 2.1000000000000001 111.202 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.64 -38.67 91.79 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 120.994 0.426 . . . . 0.51000000000000001 110.191 179.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -68.76 -25.65 64.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.66 -0.7 . . . . 2.0899999999999999 110.383 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.19 -31.06 79.44 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 111.067 -0.813 . . . . 0.66000000000000003 111.067 178.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -99.02 -3.19 35.42 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.205 -0.665 . . . . 1.6200000000000001 109.205 178.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.0 mttp 57.84 40.09 26.32 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 114.696 -1.138 . . . . 2.7000000000000002 112.05 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 24.3 mm -90.99 90.8 3.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.585 -0.524 . . . . 0.63 109.585 179.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 18.5 pt -66.85 -14.19 17.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.863 -0.608 . . . . 0.85999999999999999 111.689 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -58.48 -44.16 89.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.876 0.369 . . . . 2.2200000000000002 110.254 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -70.96 -37.33 72.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.129 -0.487 . . . . 1.3400000000000001 110.444 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -62.12 -37.42 85.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.911 -0.586 . . . . 1.3 110.851 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -80.26 -46.81 15.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.535 -0.302 . . . . 1.3200000000000001 110.677 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . 0.557 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 66.1 m -57.65 -52.1 66.82 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.057 -0.52 . . . . 0.93999999999999995 111.786 -179.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -82.44 -21.01 35.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.547 -0.297 . . . . 1.23 111.485 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -64.4 -51.3 53.67 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.861 -0.685 . . . . 0.34000000000000002 113.491 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.557 ' HE2' ' HA ' ' A' ' 82' ' ' SER . 25.9 pttt -68.15 -12.77 61.49 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.776 0.658 . . . . 1.3100000000000001 112.776 -178.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 33.1 m -109.35 -16.03 9.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 120.719 -0.392 . . . . 0.38 111.417 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.14 87.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.358 -0.383 . . . . 0.38 111.1 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.86 -38.82 83.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.056 -0.52 . . . . 0.45000000000000001 110.95 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -63.84 -52.91 57.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.745 -0.662 . . . . 1.5600000000000001 110.614 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.53 ' O ' HG12 ' A' ' 94' ' ' ILE . 99.6 t -65.38 -45.2 93.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.822 -0.627 . . . . 0.34000000000000002 111.265 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -58.49 -45.09 89.43 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.732 0.301 . . . . 1.45 111.268 -179.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -68.17 -26.06 74.27 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.729 -0.748 . . . . 0.40999999999999998 112.505 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 4.8 mmm-85 -85.54 -46.97 10.33 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.862 0.319 . . . . 3.46 111.862 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 90' ' ' VAL . 43.1 pt -65.84 -26.86 39.67 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 C-N-CA 121.119 -0.232 . . . . 0.5 111.371 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 60.7 t30 -62.27 -26.74 68.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.062 0.458 . . . . 1.0 110.493 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -81.67 -35.59 29.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.065 -0.516 . . . . 1.1399999999999999 110.422 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -81.34 -30.04 33.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.834 -0.621 . . . . 1.3300000000000001 111.396 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.411 ' HA ' ' HD3' ' A' ' 99' ' ' PRO . 8.2 m-30 -81.37 118.54 72.7 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 116.043 -0.526 . . . . 1.3899999999999999 111.613 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 98' ' ' PHE . 25.8 Cg_exo -64.35 -177.41 0.5 Allowed 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.91 2.406 . . . . 1.47 111.582 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 67.7 mtm-85 -51.08 -49.48 60.56 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.114 0.483 . . . . 4.8700000000000001 111.422 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.51 -39.23 79.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.42 -0.809 . . . . 2.5800000000000001 112.899 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 32.4 mt -86.91 -34.0 19.53 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.098 0.777 . . . . 0.84999999999999998 113.098 -177.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . 0.549 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 0.4 OUTLIER -68.2 -20.97 64.88 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.681 -0.408 . . . . 2.3599999999999999 111.115 -179.407 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -70.15 -21.69 63.05 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.064 0.459 . . . . 2.5699999999999998 109.906 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 42.7 mttm -77.91 -45.94 22.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.659 -0.701 . . . . 2.4399999999999999 110.653 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 103' ' ' LYS . 4.0 pp -65.11 -24.69 67.5 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 110.148 -0.316 . . . . 1.27 110.148 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 60.3 m -60.95 -37.75 83.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.111 0.481 . . . . 1.1499999999999999 110.152 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 28.0 ttm180 -72.95 -37.29 67.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.88 -0.6 . . . . 3.6000000000000001 109.724 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 60.3 t -62.85 -49.43 83.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.711 -0.677 . . . . 1.25 110.411 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.549 HG21 HD11 ' A' ' 131' ' ' LEU . 93.3 t -59.48 -36.61 65.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.746 -0.661 . . . . 1.1100000000000001 110.595 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -59.91 -54.28 48.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.165 -0.471 . . . . 1.74 110.467 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 55.8 mt -62.09 -40.14 86.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.94 -0.573 . . . . 1.21 110.879 -179.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.47 ' HA ' ' CG1' ' A' ' 118' ' ' ILE . 5.6 mp -63.82 -34.71 78.52 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.885 -0.598 . . . . 1.3300000000000001 112.323 -179.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.6 ptmm? -90.27 -37.94 13.75 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.417 0.525 . . . . 1.6899999999999999 112.417 -178.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -72.94 -36.03 67.11 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.347 0.499 . . . . 2.2000000000000002 112.347 -178.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -95.05 5.62 51.37 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.947 -0.301 . . . . 3.23 111.298 -178.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 51.51 71.23 0.46 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.445 0.64 . . . . 2.0 110.629 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.47 ' CG1' ' HA ' ' A' ' 113' ' ' LEU . 30.3 mm -83.94 -42.8 17.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.77 -0.65 . . . . 0.60999999999999999 110.288 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -115.07 177.94 4.47 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.075 -0.511 . . . . 1.26 110.051 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.2 t -68.7 159.89 31.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.375 -0.375 . . . . 1.3 110.464 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 45.4 mtmt -56.46 -41.53 76.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.872 -0.604 . . . . 2.8500000000000001 111.573 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -61.89 -37.61 85.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.012 -0.54 . . . . 2.9500000000000002 110.497 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.459 ' O ' HG13 ' A' ' 127' ' ' ILE . 68.1 t -70.95 -46.15 69.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.961 -0.563 . . . . 1.28 110.462 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.415 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 88.0 t -56.35 -46.78 81.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.153 -0.476 . . . . 1.23 110.62 179.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -63.03 -36.29 83.08 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.816 -0.629 . . . . 1.74 110.844 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -67.9 -40.06 83.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 1.4399999999999999 110.305 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 123' ' ' VAL . 85.3 mt -63.72 -47.08 92.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.187 -0.46 . . . . 0.46999999999999997 110.272 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 124' ' ' VAL . 43.8 mt-10 -58.23 -50.87 72.04 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.867 -0.606 . . . . 2.0499999999999998 111.286 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 12.0 ptm180 -64.81 -26.03 68.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.432 -0.349 . . . . 3.98 111.599 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 74.0 m -68.47 -37.42 80.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.074 0.464 . . . . 0.69999999999999996 110.343 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.549 HD11 HG21 ' A' ' 110' ' ' VAL . 29.5 mt -76.43 -41.87 46.07 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.856 -0.611 . . . . 1.3300000000000001 110.595 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.03 99.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.853 -0.612 . . . . 0.68999999999999995 111.8 -179.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.47 -30.44 71.56 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.256 -0.429 . . . . 0.83999999999999997 111.427 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 1.1200000000000001 110.887 -179.993 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 120.862 0.363 . . . . 5.4699999999999998 110.596 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -93.52 119.87 33.1 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.708 -0.478 . . . . 5.3399999999999999 109.708 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.471 ' HB2' ' HB3' ' A' ' 7' ' ' GLN . 16.1 m -73.25 126.31 29.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.259 -0.428 . . . . 2.73 110.773 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 m -67.01 133.12 49.29 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.177 -0.465 . . . . 3.2400000000000002 111.069 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.8 mp0 54.76 34.57 22.1 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.903 -0.59 . . . . 2.8999999999999999 111.592 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.471 ' HB3' ' HB2' ' A' ' 4' ' ' SER . 14.0 pt20 -58.82 -34.94 72.1 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.849 0.314 . . . . 2.75 111.849 -179.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -82.87 -43.49 16.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.132 0.492 . . . . 0.91000000000000003 110.083 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.77 -40.27 87.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.499 -0.773 . . . . 0.85999999999999999 112.396 -179.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 19.4 m -65.13 -37.72 88.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.692 0.282 . . . . 1.4199999999999999 111.632 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.506 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 16.8 mmmt -69.36 -33.88 73.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.698 -0.228 . . . . 1.3 111.124 -179.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.3 mt -66.58 -23.86 66.26 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.947 0.404 . . . . 1.5700000000000001 111.277 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -98.05 2.98 49.34 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.235 -0.439 . . . . 1.5900000000000001 111.841 -179.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.4 p -120.37 15.39 12.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.026 0.441 . . . . 1.6299999999999999 111.059 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 69.7 mt -97.05 165.73 11.93 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.371 0.605 . . . . 1.1000000000000001 111.674 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.447 ' HG2' ' N ' ' A' ' 17' ' ' ASP . 35.3 tt0 -134.09 166.94 21.57 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.198 -1.038 . . . . 2.1600000000000001 108.198 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.447 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 6.0 p-10 -72.77 5.83 2.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.815 0.34 . . . . 1.9399999999999999 111.293 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.9 t -84.26 139.67 32.18 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.474 -0.33 . . . . 1.6100000000000001 110.422 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -62.0 -33.02 73.56 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.166 -0.47 . . . . 2.6400000000000001 110.306 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.02 -28.45 69.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.791 -0.641 . . . . 2.9900000000000002 110.165 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 t -81.26 -53.47 6.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.924 -0.58 . . . . 1.1000000000000001 110.606 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.0 mm -56.66 -43.34 78.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.389 -0.368 . . . . 0.88 110.86 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.6 t -60.88 -35.19 75.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 1.1799999999999999 111.113 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.6 m -64.05 -32.98 74.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.267 -0.424 . . . . 1.1599999999999999 111.934 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.421 ' HB2' HD21 ' A' ' 15' ' ' LEU . . . -90.84 -35.73 14.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.87 0.367 . . . . 0.45000000000000001 110.869 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 22.4 t -62.74 -49.34 75.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.114 -0.493 . . . . 1.3200000000000001 110.664 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.41 -22.6 67.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 2.3799999999999999 110.638 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.481 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 62.1 t90 -78.91 -32.36 45.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.924 -0.58 . . . . 0.97999999999999998 109.865 179.113 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.692 HD11 HG11 ' A' ' 39' ' ' VAL . 11.5 tp -81.88 -36.83 27.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.917 -0.583 . . . . 1.3 110.883 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 79.2 mt -61.47 -22.55 65.17 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.609 0.596 . . . . 1.0600000000000001 112.609 -179.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 4.3 pp -85.79 -9.37 57.17 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.646 -0.422 . . . . 1.71 111.187 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -123.21 56.45 1.18 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.605 0.717 . . . . 1.51 110.563 -179.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 27.0 p90 -64.01 -7.12 7.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.597 -0.729 . . . . 1.6100000000000001 112.371 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -65.04 -34.26 78.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.027 0.441 . . . . 3.9700000000000002 110.662 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -96.74 23.7 6.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.757 -0.656 . . . . 1.7 111.501 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -52.37 -54.51 41.21 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 112.601 0.593 . . . . 0.42999999999999999 112.601 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.34 -29.11 46.4 Favored 'Trans proline' 0 C--N 1.355 0.89 0 C-N-CA 121.563 1.509 . . . . 0.5 112.34 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -72.71 -46.14 55.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.931 -0.577 . . . . 2.7799999999999998 111.226 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.692 HG11 HD11 ' A' ' 29' ' ' LEU . 35.8 m -71.74 -26.19 25.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.781 -0.368 . . . . 0.39000000000000001 110.6 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.94 -47.8 67.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.111 -0.495 . . . . 0.32000000000000001 111.194 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -69.85 -36.23 75.37 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.825 -0.35 . . . . 1.3999999999999999 110.448 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.2 mtm -63.89 -42.64 97.41 Favored 'General case' 0 CA--C 1.522 -0.129 0 N-CA-C 109.754 -0.462 . . . . 1.51 109.754 178.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 73.9 t90 -61.09 -47.09 87.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.575 -0.739 . . . . 0.40999999999999998 109.463 178.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.464 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 37.3 ttpt -59.23 -51.46 69.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.362 -0.835 . . . . 1.1100000000000001 110.606 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -58.78 -43.71 90.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.013 -0.539 . . . . 1.96 111.589 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -60.41 -47.32 86.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.313 -0.403 . . . . 1.5800000000000001 111.37 -179.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 55.5 mtp -72.0 -11.76 60.92 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.77 0.285 . . . . 0.69999999999999996 111.77 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 67.3 mt -95.17 -8.61 35.82 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.755 0.312 . . . . 0.88 110.65 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -79.89 130.02 68.5 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.331 -0.395 . . . . 2.6899999999999999 110.472 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.15 -8.95 24.86 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.937 2.425 . . . . 0.93999999999999995 112.436 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.43 -17.88 50.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.293 0.568 . . . . 1.3300000000000001 110.133 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 76.9 t -89.3 111.06 22.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 CA-C-N 115.394 -0.821 . . . . 0.58999999999999997 110.41 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -69.17 163.1 25.64 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.915 -0.584 . . . . 1.8 110.898 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.4 -34.98 59.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 0.81000000000000005 111.878 -179.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 40.2 mmm-85 -58.45 -48.13 81.75 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.173 0.511 . . . . 3.5800000000000001 110.49 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 36.7 mmt-85 -71.58 -35.73 70.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.789 -0.641 . . . . 3.0499999999999998 110.761 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.3 mttt -61.72 -48.32 81.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.818 0.342 . . . . 0.58999999999999997 110.372 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 24.2 tp -63.74 -37.03 85.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.149 -0.478 . . . . 1.26 110.409 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -64.44 -45.18 88.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.983 -0.553 . . . . 1.54 110.568 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.5 -31.01 77.48 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.912 -0.661 . . . . 0.37 112.015 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 43.4 tp -64.47 -36.95 85.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.959 0.409 . . . . 1.23 110.51 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -63.4 -40.17 96.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.016 -0.538 . . . . 1.3799999999999999 110.85 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 27.0 tp -62.99 -36.51 83.79 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.182 -0.463 . . . . 1.45 111.029 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.448 ' O ' HG22 ' A' ' 68' ' ' VAL . 14.3 tmm? -65.84 -46.6 77.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.271 -0.422 . . . . 0.60999999999999999 110.296 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -59.34 -39.1 82.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.075 -0.512 . . . . 1.6899999999999999 110.772 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -63.44 -56.83 13.07 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.625 -0.716 . . . . 1.54 111.849 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 27.8 m -62.71 -38.98 83.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 113.28 0.844 . . . . 1.3999999999999999 113.28 -177.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.448 HG22 ' O ' ' A' ' 64' ' ' MET . 32.6 m -73.91 -28.43 24.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 120.447 -0.501 . . . . 0.42999999999999999 111.718 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -78.51 -45.56 21.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.776 0.322 . . . . 2.02 110.468 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -71.58 -17.94 62.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.311 -0.404 . . . . 2.1000000000000001 110.875 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.49 -22.98 67.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.204 -0.453 . . . . 0.51000000000000001 111.097 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.4 mmtt -63.19 -36.59 84.14 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.279 -0.418 . . . . 2.0899999999999999 110.589 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -80.23 -28.81 47.74 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.741 -0.743 . . . . 0.66000000000000003 111.886 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -80.1 -22.26 42.37 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.795 0.331 . . . . 1.6200000000000001 110.279 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm 65.73 29.3 10.76 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.449 -0.796 . . . . 2.7000000000000002 111.111 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 33.1 mm -104.15 92.87 2.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.514 -0.767 . . . . 0.63 109.508 179.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 17.3 pt -70.3 -14.57 18.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.935 -0.575 . . . . 0.85999999999999999 111.304 -179.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 17.6 mp0 -55.69 -39.06 70.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.37 -0.377 . . . . 2.2200000000000002 110.81 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -69.23 -50.68 45.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.117 -0.492 . . . . 1.3400000000000001 110.766 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -63.89 -34.61 78.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.729 -0.669 . . . . 1.3 111.44 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.479 ' O ' ' HG2' ' A' ' 85' ' ' LYS . 6.7 t70 -67.54 -50.79 56.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.973 0.416 . . . . 1.3200000000000001 110.456 179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.7 m -66.05 -44.64 83.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.795 -0.639 . . . . 0.93999999999999995 111.981 -179.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -75.49 -27.18 58.7 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 121.04 -0.264 . . . . 1.23 111.534 -179.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.71 -44.51 89.34 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.807 -0.711 . . . . 0.34000000000000002 113.261 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' A' ' 81' ' ' ASP . 2.3 ptpp? -65.96 -27.4 68.12 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.05 0.389 . . . . 1.3100000000000001 112.05 -179.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 35.3 m -93.8 -21.8 5.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 120.742 -0.383 . . . . 0.38 111.075 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' ' 91' ' ' LEU . . . -62.84 -43.07 99.77 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.275 -0.42 . . . . 0.38 110.98 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.58 -35.42 70.37 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.117 0.484 . . . . 0.45000000000000001 110.998 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.648 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 6.1 tp10 -76.28 -56.29 4.78 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.97 -0.559 . . . . 1.5600000000000001 110.279 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 70.5 t -56.91 -46.75 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.236 -0.438 . . . . 0.34000000000000002 112.052 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.447 ' HB2' ' O ' ' A' ' 87' ' ' ALA . 2.4 mm? -60.23 -39.76 87.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.685 0.278 . . . . 1.45 110.587 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -67.93 -27.88 73.56 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.666 -0.778 . . . . 0.40999999999999998 112.248 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.648 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 11.8 mmt85 -80.48 -50.9 9.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.666 0.27 . . . . 3.46 111.014 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.418 ' HA ' ' HG2' ' A' ' 97' ' ' GLU . 41.8 pt -64.56 -31.88 55.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 111.808 0.299 . . . . 0.5 111.808 -178.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -68.8 -17.37 64.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.701 0.286 . . . . 1.0 111.385 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 11.5 pt20 -106.93 8.12 30.37 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 122.014 -0.429 . . . . 1.1399999999999999 111.776 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 6.2 pt-20 -129.79 -30.5 2.04 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.711 0.291 . . . . 1.3300000000000001 111.096 178.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -71.47 139.52 84.08 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.382 -0.372 . . . . 1.3899999999999999 111.055 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.456 ' HD2' HD12 ' A' ' 102' ' ' LEU . 37.0 Cg_endo -66.9 177.09 3.79 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.92 2.413 . . . . 1.47 112.337 178.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.522 ' O ' ' HG2' ' A' ' 103' ' ' LYS . 17.1 mmm-85 -57.33 -44.3 84.13 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.476 0.547 . . . . 4.8700000000000001 112.476 -178.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.23 -32.62 74.15 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.673 0.249 . . . . 2.5800000000000001 111.673 -178.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.456 HD12 ' HD2' ' A' ' 99' ' ' PRO . 15.6 mt -83.46 -35.54 24.87 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.823 -0.351 . . . . 0.84999999999999998 111.497 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 100' ' ' ARG . 10.9 ptmm? -63.02 -33.17 74.86 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.915 0.388 . . . . 2.3599999999999999 109.972 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 47.2 mttt -67.65 -39.6 84.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.058 -0.519 . . . . 2.5699999999999998 110.645 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.499 ' O ' HG23 ' A' ' 109' ' ' VAL . 81.9 mttt -66.14 -42.77 88.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.786 -0.643 . . . . 2.4399999999999999 110.679 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 103' ' ' LYS . 3.7 pp -72.51 -23.03 60.96 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.626 -0.429 . . . . 1.27 110.588 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 61.7 m -61.91 -45.08 95.26 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 116.53 -0.305 . . . . 1.1499999999999999 110.537 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -73.52 -27.98 61.65 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.805 -0.358 . . . . 3.6000000000000001 110.493 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.55 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 94.5 t -68.52 -47.22 78.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.335 -0.393 . . . . 1.25 110.209 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.422 ' HA ' HD12 ' A' ' 113' ' ' LEU . 9.3 p -75.69 -24.8 17.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 1.1100000000000001 110.746 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -65.26 -48.4 73.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.283 -0.417 . . . . 1.74 110.479 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.444 HG22 ' O ' ' A' ' 109' ' ' VAL . 11.4 tt -63.61 -26.19 40.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.376 -0.375 . . . . 1.21 110.867 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 87.5 mt -67.59 -41.99 83.21 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.765 0.317 . . . . 1.3300000000000001 111.003 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -84.49 -26.52 28.08 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.807 -0.357 . . . . 1.6899999999999999 111.0 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -71.49 -35.36 70.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.833 0.349 . . . . 2.2000000000000002 110.818 179.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 31.5 mmm180 -94.13 3.37 55.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.252 -0.431 . . . . 3.23 111.001 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 52.09 56.83 7.2 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.454 0.645 . . . . 2.0 110.433 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 44.5 mm -72.47 -46.45 55.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.457 -0.792 . . . . 0.60999999999999999 111.116 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -105.55 170.46 7.88 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.265 -0.425 . . . . 1.26 110.994 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.16 147.09 53.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.958 -0.565 . . . . 1.3 110.302 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -57.24 -29.2 63.59 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.931 0.396 . . . . 2.8500000000000001 111.343 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -59.56 -47.66 84.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.969 -0.559 . . . . 2.9500000000000002 111.578 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.528 ' O ' HG13 ' A' ' 127' ' ' ILE . 10.8 p -84.86 -31.27 7.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.295 -0.411 . . . . 1.28 111.274 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 39.0 t -59.34 -43.1 89.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 120.913 0.387 . . . . 1.23 110.381 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -67.69 -20.25 65.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.804 -0.635 . . . . 1.74 111.045 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -83.35 -36.12 24.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.985 0.421 . . . . 1.4399999999999999 110.266 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.528 HG13 ' O ' ' A' ' 123' ' ' VAL . 42.2 mt -68.04 -51.32 50.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.156 -0.474 . . . . 0.46999999999999997 110.875 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.58 -38.41 84.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.37 -0.377 . . . . 2.0499999999999998 111.84 -179.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 15.3 ptp180 -71.21 -33.85 70.3 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.738 -0.385 . . . . 3.98 110.65 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 67.8 m -65.16 -38.59 91.06 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.03 0.443 . . . . 0.69999999999999996 110.225 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 127' ' ' ILE . 58.2 mt -65.74 -40.2 91.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.846 -0.616 . . . . 1.3300000000000001 109.947 179.369 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.7 -33.85 66.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.784 -0.643 . . . . 0.68999999999999995 111.103 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.47 -37.54 86.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.928 0.394 . . . . 0.83999999999999997 111.126 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -71.2 -16.9 62.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.05 -0.523 . . . . 1.1200000000000001 110.888 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 131' ' ' LEU . 76.2 mt -92.1 -1.08 57.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.219 -0.446 . . . . 4.04 110.554 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -82.43 4.83 22.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.06 -0.518 . . . . 6.6399999999999997 110.721 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 35.9 m-70 . . . . . 0 C--O 1.246 0.891 0 CA-C-N 115.645 -0.707 . . . . 8.0 111.09 179.092 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 206' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo . . . . . 0 N--CA 1.484 0.915 0 N-CA-C 112.628 0.203 . . . . 7.4699999999999998 112.628 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 41.1 m 72.61 123.75 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.776 0.798 . . . . 6.0199999999999996 112.497 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . 0.552 ' CE2' ' HA ' ' B' ' 213' ' ' PRO . 44.2 t80 -110.49 128.3 55.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.571 -0.74 . . . . 4.0700000000000003 110.897 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 209' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -50.4 -33.48 37.73 Favored 'Trans proline' 0 N--CA 1.477 0.523 0 C-N-CA 123.302 2.668 . . . . 4.3499999999999996 114.37 -179.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 1.3 m -77.47 -15.12 59.49 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.803 0.335 . . . . 4.9500000000000002 111.425 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 18.5 m -129.39 78.67 75.39 Favored Pre-proline 0 C--O 1.236 0.361 0 CA-C-O 121.072 0.463 . . . . 3.1600000000000001 110.054 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 213' ' ' PRO . . . . . 0.552 ' HA ' ' CE2' ' B' ' 208' ' ' TYR . 1.9 Cg_endo -86.22 -34.6 0.15 Allowed 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 123.327 2.685 . . . . 4.0300000000000002 113.582 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 3.6 m . . . . . 0 C--O 1.246 0.907 0 CA-C-O 118.407 -0.806 . . . . 5.5700000000000003 110.371 -179.245 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.125 0 CA-C-O 120.777 0.322 . . . . 5.4699999999999998 110.846 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -138.2 122.27 17.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.382 -0.372 . . . . 5.3399999999999999 110.15 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.82 117.47 34.21 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.195 -0.457 . . . . 2.73 110.814 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.2 m -72.57 138.07 46.61 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.297 -0.411 . . . . 3.2400000000000002 111.105 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 56.97 30.43 18.08 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.622 -0.717 . . . . 2.8999999999999999 111.538 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -62.42 -31.19 71.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.036 0.446 . . . . 2.75 111.108 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -87.22 -40.36 14.62 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.102 -0.499 . . . . 0.91000000000000003 110.059 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.39 -38.85 92.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.738 -0.665 . . . . 0.85999999999999999 111.623 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.83 -29.78 69.79 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.327 -0.397 . . . . 1.4199999999999999 110.83 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.485 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 62.4 mmtt -71.8 -42.91 66.5 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 120.973 0.416 . . . . 1.3 110.625 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.92 -23.53 67.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.832 -0.622 . . . . 1.5700000000000001 111.395 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -95.21 5.04 52.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.163 -0.471 . . . . 1.5900000000000001 112.028 -178.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 p -130.61 20.47 5.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 1.6299999999999999 111.253 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 52.0 mt -102.87 133.17 48.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.865 0.364 . . . . 1.1000000000000001 111.577 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -100.32 173.69 6.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.601 -0.727 . . . . 2.1600000000000001 109.359 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -80.83 35.57 0.37 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.408 0.623 . . . . 1.9399999999999999 110.896 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.483 ' HB3' ' OG ' ' A' ' 21' ' ' SER . 4.0 t -107.26 136.95 46.2 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.102 -0.499 . . . . 1.6100000000000001 109.735 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.475 ' OE1' ' HA ' ' B' ' 208' ' ' TYR . 0.0 OUTLIER -57.87 -44.0 86.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.935 -0.575 . . . . 2.6400000000000001 111.289 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -62.97 -39.47 94.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.688 0.28 . . . . 2.9900000000000002 111.432 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.483 ' OG ' ' HB3' ' A' ' 18' ' ' SER . 4.7 m -62.43 -50.56 71.01 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.356 -0.384 . . . . 1.1000000000000001 110.387 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.9 mm -63.42 -38.43 82.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.261 -0.427 . . . . 0.88 109.983 179.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 47.0 t -60.31 -39.34 86.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.936 -0.574 . . . . 1.1799999999999999 110.539 179.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.4 m -61.09 -45.42 94.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 1.1599999999999999 110.752 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.12 -34.29 66.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.397 -0.365 . . . . 0.45000000000000001 110.827 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 44.0 t -62.7 -50.75 69.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.972 -0.558 . . . . 1.3200000000000001 110.373 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -59.12 -37.12 76.46 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.133 0.492 . . . . 2.3799999999999999 110.495 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.453 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 9.3 t90 -66.39 -39.13 88.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.379 -0.828 . . . . 0.97999999999999998 110.724 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.7 tp -76.05 -35.51 59.41 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.406 -0.361 . . . . 1.3 111.015 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 78.4 mt -60.18 -32.02 70.68 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.179 -0.464 . . . . 1.0600000000000001 112.248 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 2.8 pp -78.62 -26.66 45.33 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.793 -0.363 . . . . 1.71 111.21 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -98.1 48.74 1.0 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.627 0.727 . . . . 1.51 110.669 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.6 p90 -70.9 -4.22 23.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.462 -0.79 . . . . 1.6100000000000001 111.467 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -70.54 -30.09 66.73 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.168 -0.679 . . . . 3.9700000000000002 109.168 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -107.94 31.87 5.18 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.202 -0.908 . . . . 1.7 110.091 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.456 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -51.57 -51.6 68.12 Favored Pre-proline 0 CA--C 1.537 0.452 0 CA-C-N 115.653 -0.703 . . . . 0.42999999999999999 112.097 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 32.8 Cg_endo -64.42 -31.63 61.55 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 121.582 1.521 . . . . 0.5 111.822 179.212 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 42' ' ' MET . 0.6 OUTLIER -67.5 -47.74 69.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.866 -0.606 . . . . 2.7799999999999998 111.247 -179.255 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.2 m -71.97 -27.51 27.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 C-N-CA 120.705 -0.398 . . . . 0.39000000000000001 110.322 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.13 -47.27 62.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.166 -0.47 . . . . 0.32000000000000001 110.426 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -68.66 -35.91 77.87 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.226 -0.443 . . . . 1.3999999999999999 109.992 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.413 ' HB2' ' O ' ' A' ' 38' ' ' LYS . 14.7 ttm -64.26 -42.85 96.28 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.06 -0.518 . . . . 1.51 110.119 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 61.9 t90 -60.14 -52.08 66.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.446 -0.797 . . . . 0.40999999999999998 110.674 179.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.0 ttpt -61.03 -50.22 74.23 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.633 -0.712 . . . . 1.1100000000000001 111.629 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -61.46 -33.66 74.12 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.307 -0.406 . . . . 1.96 112.045 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -73.9 -44.51 55.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.628 0.251 . . . . 1.5800000000000001 111.004 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 62.6 mtp -70.48 -13.46 62.13 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.002 0.371 . . . . 0.69999999999999996 112.002 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 49.9 mt -92.93 2.15 56.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.943 0.401 . . . . 0.88 110.609 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 59.2 mtp180 -88.0 136.5 32.21 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.105 -0.498 . . . . 2.6899999999999999 110.443 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -68.98 -12.61 34.78 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.793 2.328 . . . . 0.93999999999999995 112.337 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.44 -6.35 56.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.791 -0.641 . . . . 1.3300000000000001 111.191 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 42.3 t -100.38 118.53 47.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.94 0.4 . . . . 0.58999999999999997 110.798 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -74.68 158.45 33.57 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.799 -0.637 . . . . 1.8 110.223 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -33.23 62.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.403 -0.362 . . . . 0.81000000000000005 111.781 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.0 mmm-85 -59.48 -44.74 92.98 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.142 -0.481 . . . . 3.5800000000000001 110.939 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.403 ' HD3' ' HA ' ' A' ' 56' ' ' ARG . 12.4 mmt180 -75.84 -30.35 58.92 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.436 -0.347 . . . . 3.0499999999999998 110.88 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -64.16 -41.98 96.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.03 0.443 . . . . 0.58999999999999997 109.888 179.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 25.6 tp -66.41 -40.57 89.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.832 -0.622 . . . . 1.26 110.216 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -64.53 -41.83 96.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.051 -0.522 . . . . 1.54 110.388 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.19 -36.68 93.17 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.791 -0.719 . . . . 0.37 111.619 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 30.6 tp -63.8 -35.9 82.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.937 0.399 . . . . 1.23 110.122 178.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -65.09 -41.21 95.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.862 -0.608 . . . . 1.3799999999999999 110.773 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 23.9 tp -64.94 -42.47 94.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.262 -0.426 . . . . 1.45 110.495 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 14.1 tmm? -61.52 -45.64 93.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.033 -0.53 . . . . 0.60999999999999999 110.154 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -61.36 -36.32 79.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.83 -0.623 . . . . 1.6899999999999999 111.089 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.564 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 4.3 t-80 -67.05 -56.88 8.16 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.744 -0.662 . . . . 1.54 111.456 -179.442 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 35.0 m -59.74 -39.29 79.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.218 0.821 . . . . 1.3999999999999999 113.218 -177.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 34.7 m -71.12 -27.31 29.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 120.466 -0.494 . . . . 0.42999999999999999 112.049 -178.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 62.7 mt-30 -73.68 -46.44 46.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.942 0.401 . . . . 2.02 110.131 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.564 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 37.5 mm-40 -74.58 -21.33 59.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.863 -0.608 . . . . 2.1000000000000001 110.934 -179.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.58 -35.01 71.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.304 -0.407 . . . . 0.51000000000000001 111.1 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -74.68 -20.81 59.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.86 0.362 . . . . 2.0899999999999999 110.634 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -73.77 -32.54 59.05 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.698 -0.763 . . . . 0.66000000000000003 111.241 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -97.69 -0.76 44.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.186 0.517 . . . . 1.6200000000000001 109.87 179.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.8 mmmm 63.19 40.68 8.63 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.12 -0.945 . . . . 2.7000000000000002 111.252 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.3 mm -100.25 86.28 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.091 -0.504 . . . . 0.63 109.783 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 25.2 pt -68.78 -18.6 23.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.847 -0.615 . . . . 0.85999999999999999 111.489 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -59.47 -41.49 89.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.09 -0.505 . . . . 2.2200000000000002 110.834 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -66.68 -50.68 62.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.852 -0.613 . . . . 1.3400000000000001 111.188 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -62.06 -34.47 76.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.674 -0.694 . . . . 1.3 111.885 -178.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.49 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 13.8 t70 -71.26 -53.68 13.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.706 0.288 . . . . 1.3200000000000001 110.359 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.9 m -59.28 -44.09 92.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.882 -0.599 . . . . 0.93999999999999995 112.04 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -77.29 -35.82 54.76 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.771 0.285 . . . . 1.23 111.771 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.85 -41.21 97.59 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 121.178 -0.534 . . . . 0.34000000000000002 114.039 -178.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.49 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 12.7 ptpt -65.71 -31.12 71.94 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.324 0.49 . . . . 1.3100000000000001 112.324 -178.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.3 m -95.83 -19.38 6.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.64 -0.424 . . . . 0.38 111.241 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.68 -42.14 99.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.394 -0.367 . . . . 0.38 111.242 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.29 -41.71 80.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.439 . . . . 0.45000000000000001 110.985 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.622 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 6.3 tp10 -67.0 -54.04 25.57 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.902 -0.59 . . . . 1.5600000000000001 110.493 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 96.0 t -59.3 -45.65 93.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 0.34000000000000002 111.607 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -56.78 -44.16 81.58 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.538 -0.301 . . . . 1.45 111.293 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -66.97 -37.19 91.97 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.454 -0.879 . . . . 0.40999999999999998 112.424 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.622 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 9.8 mmt180 -68.17 -48.4 65.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.696 0.284 . . . . 3.46 110.958 -179.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.493 ' HA ' ' HG2' ' A' ' 97' ' ' GLU . 45.2 pt -70.08 -23.88 25.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.079 0.466 . . . . 0.5 111.043 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.486 ' ND2' ' HB3' ' A' ' 134' ' ' ALA . 7.1 t30 -65.79 -24.67 66.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.975 -0.557 . . . . 1.0 110.832 179.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.522 ' HB3' ' HB1' ' A' ' 134' ' ' ALA . 9.6 pt20 -110.63 1.25 17.9 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.55 0.574 . . . . 1.1399999999999999 112.55 -178.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.493 ' HG2' ' HA ' ' A' ' 94' ' ' ILE . 1.5 pt-20 -117.69 -20.05 9.08 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.864 -0.334 . . . . 1.3300000000000001 111.665 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -80.87 145.77 58.18 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 120.799 0.333 . . . . 1.3899999999999999 111.279 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -66.26 171.78 9.83 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 123.046 2.498 . . . . 1.47 112.164 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -56.99 -42.66 80.65 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.565 0.58 . . . . 4.8700000000000001 112.565 -178.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.21 -46.79 76.02 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 121.133 -0.227 . . . . 2.5800000000000001 111.299 -178.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.487 HD23 ' HD2' ' A' ' 105' ' ' LYS . 36.7 mt -71.81 -29.69 64.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.827 0.346 . . . . 0.84999999999999998 110.67 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . 0.428 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 0.0 OUTLIER -56.02 -50.89 69.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.773 -0.648 . . . . 2.3599999999999999 110.574 179.53 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 57.1 tttt -66.04 -36.07 82.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.265 -0.425 . . . . 2.5699999999999998 110.659 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.487 ' HD2' HD23 ' A' ' 102' ' ' LEU . 88.5 mttt -63.58 -44.06 95.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.148 -0.478 . . . . 2.4399999999999999 110.913 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.473 ' O ' HG12 ' A' ' 109' ' ' VAL . 1.7 pp -74.54 -27.86 60.7 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.974 -0.291 . . . . 1.27 110.693 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 52.4 m -67.47 -41.05 85.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.515 -0.312 . . . . 1.1499999999999999 111.242 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.462 ' O ' HG13 ' A' ' 112' ' ' ILE . 16.3 ptt180 -76.57 -31.75 57.74 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.848 -0.341 . . . . 3.6000000000000001 110.708 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -69.02 -38.92 79.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-O 120.69 0.281 . . . . 1.25 110.637 -179.86 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 8.4 p -80.1 -21.13 11.83 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-O 121.257 0.551 . . . . 1.1100000000000001 110.066 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -68.05 -41.6 81.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.743 -0.662 . . . . 1.74 109.625 179.397 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 108' ' ' ARG . 67.1 mt -62.64 -36.23 74.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.851 -0.613 . . . . 1.21 110.047 179.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 87.7 mt -61.84 -49.34 76.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 1.3300000000000001 111.245 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -75.63 -28.04 58.65 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 121.008 -0.277 . . . . 1.6899999999999999 111.59 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.448 ' HA ' ' OE1' ' A' ' 115' ' ' GLU . 2.6 mm-40 -73.71 -39.2 64.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.711 0.291 . . . . 2.2000000000000002 111.064 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -83.79 -0.6 51.71 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.803 0.335 . . . . 3.23 110.367 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.89 48.42 8.92 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.435 -0.802 . . . . 2.0 110.808 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 42.9 mm -70.42 -46.14 72.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.75 -0.659 . . . . 0.60999999999999999 109.979 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -101.84 164.71 11.58 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.811 -0.631 . . . . 1.26 110.19 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.6 t -68.77 145.82 53.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.211 -0.449 . . . . 1.3 110.162 179.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -59.03 -25.94 64.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.487 -0.324 . . . . 2.8500000000000001 110.778 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -62.39 -38.56 90.08 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.074 -0.512 . . . . 2.9500000000000002 111.09 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.473 ' O ' HG13 ' A' ' 127' ' ' ILE . 12.9 p -90.27 -31.48 5.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.841 -0.344 . . . . 1.28 110.504 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.405 ' O ' ' HG2' ' A' ' 128' ' ' GLU . 47.7 t -59.8 -38.33 75.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 120.984 0.421 . . . . 1.23 110.245 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -62.25 -26.53 68.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.809 -0.632 . . . . 1.74 110.77 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.528 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 38.7 t70 -87.28 -36.67 17.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.351 -0.386 . . . . 1.4399999999999999 110.205 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.521 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 77.2 mt -60.89 -50.51 80.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.226 -0.443 . . . . 0.46999999999999997 110.723 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 124' ' ' VAL . 4.6 pt-20 -63.73 -37.29 86.79 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.396 -0.365 . . . . 2.0499999999999998 111.578 -179.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.528 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 6.5 ptp180 -70.34 -32.47 70.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.621 -0.263 . . . . 3.98 110.852 -179.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 49.0 m -65.89 -40.2 91.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.885 0.374 . . . . 0.69999999999999996 110.394 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 127' ' ' ILE . 23.8 mt -66.26 -44.41 83.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.988 -0.551 . . . . 1.3300000000000001 110.245 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.91 -36.63 78.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.886 -0.597 . . . . 0.68999999999999995 111.715 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -59.25 -46.18 89.19 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.963 0.357 . . . . 0.83999999999999997 111.963 -179.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.522 ' HB1' ' HB3' ' A' ' 96' ' ' GLN . . . -68.3 -18.73 64.59 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.855 0.359 . . . . 1.1200000000000001 111.468 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 131' ' ' LEU . 97.4 mt -87.43 -6.9 58.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.393 -0.367 . . . . 4.04 110.573 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -76.43 -22.28 54.85 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.256 -0.429 . . . . 6.6399999999999997 110.052 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 . . . . . 0 C--O 1.248 0.993 0 CA-C-N 115.422 -0.808 . . . . 8.0 110.507 -179.993 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 206' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo . . . . . 0 N--CA 1.482 0.816 0 N-CA-C 112.462 0.139 . . . . 7.4699999999999998 112.462 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 2.2 m 59.33 80.52 0.19 Allowed 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.152 0.501 . . . . 6.0199999999999996 112.021 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . 0.475 ' HA ' ' OE1' ' A' ' 19' ' ' GLN . 66.8 t80 -62.77 129.76 41.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.46 -0.336 . . . . 4.0700000000000003 110.524 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 209' ' ' SEP . . . . . 0.426 ' HA ' ' HD3' ' B' ' 210' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' B' ' 209' ' ' SEP . 31.4 Cg_exo -60.59 -27.89 85.64 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.907 2.405 . . . . 4.3499999999999996 112.73 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.93 -4.95 58.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.185 0.517 . . . . 4.9500000000000002 110.696 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 19.2 m -137.95 77.53 37.53 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.028 -0.533 . . . . 3.1600000000000001 110.092 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 213' ' ' PRO . . . . . 0.463 ' HB2' ' NE2' ' A' ' 66' ' ' HIS . 87.5 Cg_endo -89.13 -7.15 5.25 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.723 2.282 . . . . 4.0300000000000002 113.445 -179.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 66.2 m . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.542 -0.742 . . . . 5.5700000000000003 110.463 -179.649 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 120.813 0.34 . . . . 5.4699999999999998 110.763 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -80.76 140.41 35.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.415 -0.357 . . . . 5.3399999999999999 110.551 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.9 m -66.87 111.57 3.83 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.223 -0.444 . . . . 2.73 110.685 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.5 m -92.97 160.17 15.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.232 -0.44 . . . . 3.2400000000000002 110.491 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 54.62 38.76 30.49 Favored 'General case' 0 N--CA 1.464 0.229 0 O-C-N 123.655 0.597 . . . . 2.8999999999999999 111.845 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -64.6 -34.78 79.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.321 -0.4 . . . . 2.75 110.617 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -64.13 -47.38 80.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.945 -0.57 . . . . 0.91000000000000003 110.285 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -39.14 93.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.06 -0.518 . . . . 0.85999999999999999 110.881 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 12.2 m -63.36 -35.89 81.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.964 -0.562 . . . . 1.4199999999999999 110.59 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.503 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 65.4 mmtt -65.04 -41.86 94.82 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.046 -0.524 . . . . 1.3 110.247 179.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -62.0 -34.49 76.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.853 -0.612 . . . . 1.5700000000000001 111.235 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -77.98 -5.67 52.0 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.992 -0.549 . . . . 1.5900000000000001 111.695 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 p -123.83 18.56 9.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.815 0.34 . . . . 1.6299999999999999 111.604 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 17.0 mt -95.16 169.11 10.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.087 0.47 . . . . 1.1000000000000001 111.39 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -139.79 -174.27 3.86 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.72 -0.673 . . . . 2.1600000000000001 109.215 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -91.5 12.1 21.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.779 0.323 . . . . 1.9399999999999999 111.424 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.478 ' O ' HG12 ' A' ' 22' ' ' ILE . 0.1 OUTLIER -85.41 132.25 34.25 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.867 -0.419 . . . . 1.6100000000000001 109.867 179.093 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.512 ' OE1' ' HA ' ' B' ' 208' ' ' TYR . 0.0 OUTLIER -62.13 -29.37 70.29 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.69 0.281 . . . . 2.6400000000000001 110.749 -179.455 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 -67.55 -44.09 79.1 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.811 -0.44 . . . . 2.9900000000000002 109.811 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.1 m -64.63 -41.24 96.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.929 -0.578 . . . . 1.1000000000000001 109.922 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 18' ' ' SER . 38.3 mm -63.41 -49.0 84.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 N-CA-C 109.257 -0.645 . . . . 0.88 109.257 178.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.8 m -57.28 -35.8 70.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.127 -0.488 . . . . 1.1799999999999999 111.001 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.5 t -59.82 -40.07 87.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.456 . . . . 1.1599999999999999 111.077 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.5 -43.65 13.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.319 -0.401 . . . . 0.45000000000000001 111.206 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.405 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 37.9 m -59.36 -41.31 88.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.255 -0.43 . . . . 1.3200000000000001 111.624 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.524 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 21.2 ttpt -61.95 -35.25 77.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.755 0.312 . . . . 2.3799999999999999 110.194 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.526 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 25.0 t90 -72.81 -40.61 65.7 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.47 -0.567 . . . . 0.97999999999999998 109.47 179.265 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -62.95 -38.46 91.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.831 -0.622 . . . . 1.3 110.756 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 26' ' ' SER . 86.4 mt -63.75 -28.26 69.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.985 0.421 . . . . 1.0600000000000001 110.537 179.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 68.9 mt -76.09 -27.63 57.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.945 -0.571 . . . . 1.71 109.546 178.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' A' ' 28' ' ' TRP . 50.1 mm-40 -97.24 36.86 1.39 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.479 -0.782 . . . . 1.51 110.211 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.8 p90 -67.26 -1.58 4.74 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 121.057 0.456 . . . . 1.6100000000000001 111.304 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -82.83 -8.8 59.55 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.02 -0.536 . . . . 3.9700000000000002 109.86 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -131.39 37.75 3.67 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.687 -0.688 . . . . 1.7 110.343 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.439 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -57.36 -52.23 75.78 Favored Pre-proline 0 CA--C 1.537 0.481 0 CA-C-N 115.869 -0.605 . . . . 0.42999999999999999 112.45 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.442 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 32.4 Cg_endo -64.74 -27.02 60.19 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 121.797 1.665 . . . . 0.5 112.362 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.6 -39.08 77.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.983 -0.553 . . . . 2.7799999999999998 111.091 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 24.6 m -85.59 -22.58 7.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 120.61 -0.436 . . . . 0.39000000000000001 110.669 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.36 -46.08 74.42 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.199 -0.455 . . . . 0.32000000000000001 110.737 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 3.3 pt-20 -64.13 -40.75 96.84 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.257 -0.429 . . . . 1.3999999999999999 110.052 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.422 ' N ' ' HG3' ' A' ' 41' ' ' GLU . 42.5 ttm -64.67 -41.07 96.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.596 -0.729 . . . . 1.51 110.521 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -62.18 -49.48 75.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.743 -0.662 . . . . 0.40999999999999998 110.36 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.458 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 23.2 ttpp -57.82 -51.28 70.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.921 -0.581 . . . . 1.1100000000000001 111.04 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.416 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 11.4 mm-40 -61.28 -38.65 87.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.144 -0.48 . . . . 1.96 111.168 -179.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.436 ' O ' HG21 ' A' ' 52' ' ' VAL . 79.1 t80 -62.03 -46.65 88.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.921 0.391 . . . . 1.5800000000000001 110.67 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 76.9 mmm -67.05 -25.2 66.14 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.2 -0.454 . . . . 0.69999999999999996 111.407 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 82.0 mt -93.94 12.7 25.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.396 -0.365 . . . . 0.88 111.299 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 11.9 mtp85 -96.66 133.56 24.39 Favored Pre-proline 0 C--N 1.327 -0.401 0 N-CA-C 110.333 -0.247 . . . . 2.6899999999999999 110.333 179.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -70.28 -15.89 35.26 Favored 'Trans proline' 0 CA--C 1.53 0.284 0 C-N-CA 122.924 2.416 . . . . 0.93999999999999995 113.307 -179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.69 10.47 7.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.032 0.444 . . . . 1.3300000000000001 110.946 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.436 HG21 ' O ' ' A' ' 46' ' ' TYR . 41.2 t -110.39 122.0 64.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.949 -0.569 . . . . 0.58999999999999997 110.514 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -69.01 156.45 38.6 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.96 -0.564 . . . . 1.8 110.93 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.12 -41.81 72.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.876 0.369 . . . . 0.81000000000000005 111.73 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -68.89 -29.81 68.17 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.423 -0.353 . . . . 3.5800000000000001 110.497 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.0 mmm-85 -70.96 -38.68 72.82 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.602 -0.518 . . . . 3.0499999999999998 109.602 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -67.21 -34.82 78.3 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.377 -0.601 . . . . 0.58999999999999997 109.377 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 20.1 tp -63.05 -37.97 89.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.581 -0.736 . . . . 1.26 109.927 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 mp -66.25 -40.59 90.3 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.688 -0.687 . . . . 1.54 110.007 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.66 -33.79 88.18 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.916 -0.659 . . . . 0.37 111.562 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.84 -44.13 86.41 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.391 -0.596 . . . . 1.23 109.391 178.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -61.78 -39.47 91.81 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.284 -0.871 . . . . 1.3799999999999999 110.876 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 20.2 tp -63.6 -41.28 98.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.928 -0.578 . . . . 1.45 110.389 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.484 ' O ' HG22 ' A' ' 68' ' ' VAL . 16.9 tmm? -62.87 -51.57 66.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.886 -0.597 . . . . 0.60999999999999999 110.699 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -56.11 -35.52 67.15 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.063 0.458 . . . . 1.6899999999999999 110.923 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -68.67 -58.12 4.7 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.709 -0.678 . . . . 1.54 111.687 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 17.5 m -60.52 -39.86 82.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 113.052 0.76 . . . . 1.3999999999999999 113.052 -177.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.484 HG22 ' O ' ' A' ' 64' ' ' MET . 30.7 m -72.96 -31.03 34.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 120.515 -0.474 . . . . 0.42999999999999999 111.88 -178.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -77.7 -43.09 32.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.954 0.407 . . . . 2.02 110.473 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -71.52 -24.89 62.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.197 -0.456 . . . . 2.1000000000000001 110.588 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.29 -18.72 65.52 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.297 -0.41 . . . . 0.51000000000000001 110.566 179.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt -68.29 -29.21 67.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.27 -0.423 . . . . 2.0899999999999999 109.879 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.2 -47.73 28.68 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.965 -0.636 . . . . 0.66000000000000003 111.574 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -78.75 -7.68 58.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.919 0.39 . . . . 1.6200000000000001 110.289 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.7 mttp 60.46 40.27 17.37 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.489 -0.778 . . . . 2.7000000000000002 111.267 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 40.1 mm -93.25 94.79 4.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.766 -0.652 . . . . 0.63 109.813 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 10.9 pt -70.73 -22.47 23.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.083 -0.508 . . . . 0.85999999999999999 111.224 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -56.23 -33.46 65.41 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.916 0.389 . . . . 2.2200000000000002 110.702 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -71.51 -53.44 13.85 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.934 -0.576 . . . . 1.3400000000000001 110.577 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -63.88 -31.54 72.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.82 -0.627 . . . . 1.3 111.799 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -71.23 -57.36 4.56 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.964 0.412 . . . . 1.3200000000000001 111.426 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.9 m -65.36 -42.35 92.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.878 -0.601 . . . . 0.93999999999999995 112.327 -178.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -78.32 -28.66 47.38 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.7 -0.4 . . . . 1.23 111.184 -179.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -68.23 -42.9 82.09 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.777 -0.725 . . . . 0.34000000000000002 113.051 -179.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -65.3 -27.12 68.39 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.019 0.377 . . . . 1.3100000000000001 112.019 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.6 m -97.26 -18.29 6.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-O 120.772 0.32 . . . . 0.38 111.316 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.23 -45.53 91.2 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.254 -0.43 . . . . 0.38 111.382 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -50.88 -46.69 60.56 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.386 0.429 . . . . 0.45000000000000001 111.515 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.596 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 3.5 tp10 -62.43 -60.03 4.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.76 -0.654 . . . . 1.5600000000000001 110.529 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.452 ' O ' HG12 ' A' ' 94' ' ' ILE . 80.0 t -54.97 -49.4 71.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.837 -0.619 . . . . 0.34000000000000002 112.363 -178.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 82.0 mt -61.09 -38.0 84.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.611 0.243 . . . . 1.45 111.629 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -72.22 -31.06 64.2 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.544 -0.836 . . . . 0.40999999999999998 112.0 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.596 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 47.8 mmm-85 -76.59 -50.35 14.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.514 0.197 . . . . 3.46 111.233 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.452 HG12 ' O ' ' A' ' 90' ' ' VAL . 22.2 pt -65.18 -20.82 28.24 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.282 0 CA-C-O 120.609 0.242 . . . . 0.5 111.167 -179.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -62.86 -26.8 68.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.687 0.755 . . . . 1.0 109.677 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -101.59 2.94 39.48 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.469 -0.787 . . . . 1.1399999999999999 110.785 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -116.65 -15.87 10.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.134 -0.485 . . . . 1.3300000000000001 111.281 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -95.1 125.63 49.77 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.22 -0.446 . . . . 1.3899999999999999 111.193 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -61.79 174.5 2.28 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.719 2.279 . . . . 1.47 112.042 178.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.416 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 14.6 ptt-85 -49.95 -33.46 17.71 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.835 0.68 . . . . 4.8700000000000001 112.835 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -75.07 -52.77 10.22 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.928 -0.309 . . . . 2.5800000000000001 111.683 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 35.5 mt -66.75 -35.63 80.56 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.225 0.454 . . . . 0.84999999999999998 112.225 -178.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -65.83 -30.18 70.76 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.857 -0.337 . . . . 2.3599999999999999 110.821 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 100' ' ' ARG . 43.1 mtmt -68.63 -23.87 64.48 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.329 0.585 . . . . 2.5699999999999998 109.748 178.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 52.9 mttp -84.14 -28.95 27.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.446 -0.797 . . . . 2.4399999999999999 108.977 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 26.1 tp -64.51 -45.33 87.74 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.498 -0.774 . . . . 1.27 109.823 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 1.4 p -63.87 -25.87 68.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 1.1499999999999999 110.674 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 39.3 mtt-85 -72.61 -24.35 61.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.949 -0.569 . . . . 3.6000000000000001 110.982 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.5 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 49.0 t -91.48 -48.77 13.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 116.081 -0.509 . . . . 1.25 110.105 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 71.8 t -56.66 -44.36 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.67 -0.695 . . . . 1.1100000000000001 112.187 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.93 -38.46 91.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.616 0.246 . . . . 1.74 111.256 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 57.9 mt -71.02 -40.05 75.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.801 0.334 . . . . 1.21 110.777 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 89.5 mt -58.72 -39.52 81.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 1.3300000000000001 111.913 -179.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 11.7 ptpt -83.08 -40.86 19.3 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.976 -0.289 . . . . 1.6899999999999999 111.759 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -66.71 -33.83 76.49 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.034 0.383 . . . . 2.2000000000000002 112.034 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.7 mmm180 -85.73 0.04 53.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.751 -0.204 . . . . 3.23 110.993 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 56.14 52.03 10.95 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.33 0.586 . . . . 2.0 110.116 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 49.7 mm -77.35 -49.12 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.837 -0.62 . . . . 0.60999999999999999 110.481 -179.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -102.25 171.98 7.16 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.087 -0.506 . . . . 1.26 110.327 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.22 158.83 35.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.998 -0.547 . . . . 1.3 110.341 179.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.417 ' O ' ' HB2' ' A' ' 125' ' ' ASN . 2.0 mmmt -57.41 -39.82 76.99 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.515 -0.311 . . . . 2.8500000000000001 111.584 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -66.66 -27.77 67.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.749 0.309 . . . . 2.9500000000000002 111.141 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 90.0 t -80.73 -51.22 16.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.47 -0.332 . . . . 1.28 111.243 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.516 ' O ' ' HG2' ' A' ' 128' ' ' GLU . 26.9 m -61.74 -30.2 47.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.772 0.32 . . . . 1.23 111.131 -179.451 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -72.29 -27.32 62.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.208 -0.451 . . . . 1.74 110.654 179.589 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -79.16 -36.27 40.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.187 -0.46 . . . . 1.4399999999999999 110.023 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 81.3 mt -63.4 -54.61 30.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.873 -0.603 . . . . 0.46999999999999997 111.049 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 124' ' ' VAL . 5.2 pt-20 -61.59 -38.68 88.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.351 -0.386 . . . . 2.0499999999999998 111.794 -178.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -68.15 -29.25 68.1 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.751 -0.38 . . . . 3.98 110.724 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 65.0 m -72.17 -40.36 68.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.839 0.352 . . . . 0.69999999999999996 110.161 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.1 mp -64.12 -39.42 93.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.191 0.519 . . . . 1.3300000000000001 109.922 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.05 -42.28 63.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.502 -0.772 . . . . 0.68999999999999995 111.213 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.44 -25.58 67.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.83999999999999997 111.274 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -72.6 -15.45 61.74 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.096 -0.502 . . . . 1.1200000000000001 110.75 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 32.0 mt 64.19 12.29 6.98 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.932 -0.576 . . . . 4.04 111.637 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -102.78 68.62 1.03 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.259 0.552 . . . . 6.6399999999999997 110.574 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 . . . . . 0 C--O 1.244 0.783 0 CA-C-O 118.442 -0.789 . . . . 8.0 109.867 179.683 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 206' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo . . . . . 0 CA--C 1.533 0.44 0 CA-C-O 120.086 -0.048 . . . . 7.4699999999999998 112.193 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 18.5 m 67.4 99.94 0.05 Allowed 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.745 0.783 . . . . 6.0199999999999996 112.231 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . 0.512 ' HA ' ' OE1' ' A' ' 19' ' ' GLN . 28.7 t80 -71.09 128.42 35.89 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.705 -0.679 . . . . 4.0700000000000003 109.958 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 209' ' ' SEP . . . . . 0.409 ' HA ' ' HD3' ' B' ' 210' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' B' ' 209' ' ' SEP . 31.4 Cg_exo -60.18 -30.27 90.92 Favored 'Trans proline' 0 N--CA 1.476 0.463 0 C-N-CA 122.813 2.342 . . . . 4.3499999999999996 112.934 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -91.11 -8.5 48.65 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.099 -0.501 . . . . 4.9500000000000002 110.889 -179.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 72.6 m -134.76 78.52 54.92 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 109.63 -0.507 . . . . 3.1600000000000001 109.63 179.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 213' ' ' PRO . . . . . 0.427 ' HA ' ' CE2' ' B' ' 208' ' ' TYR . 11.3 Cg_exo -71.66 -24.1 22.17 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 123.193 2.595 . . . . 4.0300000000000002 113.139 -178.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 3.4 m . . . . . 0 C--O 1.251 1.147 0 CA-C-O 118.342 -0.837 . . . . 5.5700000000000003 110.428 -179.464 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.206 0 CA-C-O 120.857 0.361 . . . . 5.4699999999999998 111.003 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -88.9 160.53 17.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.335 -0.393 . . . . 5.3399999999999999 110.521 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.13 103.41 0.61 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.892 -0.595 . . . . 2.73 111.273 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.3 m -80.6 157.02 26.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.856 -0.611 . . . . 3.2400000000000002 110.276 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 58.71 39.39 24.4 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.287 -0.415 . . . . 2.8999999999999999 111.231 -179.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.481 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 18.5 mt-30 -60.8 -38.44 85.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.29 -0.414 . . . . 2.75 111.521 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.618 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 82.4 t80 -77.12 -43.94 32.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.039 0.447 . . . . 0.91000000000000003 110.785 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.0 -41.22 96.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.907 -0.588 . . . . 0.85999999999999999 112.358 -179.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.9 t -69.39 -24.39 63.86 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.709 -0.223 . . . . 1.4199999999999999 111.408 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 71.2 mmtt -68.11 -37.62 81.35 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.973 0.416 . . . . 1.3 110.052 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -62.22 -32.59 73.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.602 -0.726 . . . . 1.5700000000000001 111.153 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 54.8 m-20 -77.57 -11.32 59.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.108 -0.496 . . . . 1.5900000000000001 111.287 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.99 9.66 18.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.843 0.354 . . . . 1.6299999999999999 111.465 -179.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 15' ' ' LEU . 17.9 mt -85.94 165.0 17.1 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.129 0.49 . . . . 1.1000000000000001 111.372 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -144.18 169.58 17.61 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.581 -0.736 . . . . 2.1600000000000001 109.458 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -84.38 41.9 0.86 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.425 0.631 . . . . 1.9399999999999999 111.453 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -119.33 139.23 52.3 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.991 -0.55 . . . . 1.6100000000000001 109.708 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' B' ' 213' ' ' PRO . 5.2 pm0 -61.39 -39.58 91.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.679 -0.237 . . . . 2.6400000000000001 111.016 -179.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.77 -42.22 99.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.123 0.487 . . . . 2.9900000000000002 110.258 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.8 m -65.28 -46.98 78.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.025 -0.534 . . . . 1.1000000000000001 111.012 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 38.4 mm -65.39 -44.98 94.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 CA-C-N 116.354 -0.384 . . . . 0.88 110.235 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.9 t -56.18 -43.38 78.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.876 -0.602 . . . . 1.1799999999999999 111.082 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.0 m -59.21 -36.85 76.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.247 -0.433 . . . . 1.1599999999999999 111.868 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -83.01 -40.52 19.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.767 0.318 . . . . 0.45000000000000001 111.111 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.6 m -62.29 -43.64 98.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.301 -0.409 . . . . 1.3200000000000001 111.038 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.623 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 0.3 OUTLIER -64.06 -38.74 92.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.318 -0.401 . . . . 2.3799999999999999 110.095 179.67 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 37.5 t90 -64.89 -38.57 91.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.025 -0.534 . . . . 0.97999999999999998 110.287 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -67.09 -45.31 77.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.98 -0.555 . . . . 1.3 111.142 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 74.1 mt -64.26 -21.37 66.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.961 -0.563 . . . . 1.0600000000000001 112.052 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 66.0 mt -70.64 -24.45 62.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.752 0.311 . . . . 1.71 110.991 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.15 72.08 1.45 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.087 0.47 . . . . 1.51 110.991 -179.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.5 p90 -75.17 9.18 2.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.94 -0.573 . . . . 1.6100000000000001 110.729 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 33.1 mtp-105 -71.0 -25.1 62.54 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.782 -0.644 . . . . 3.9700000000000002 110.499 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -117.13 33.3 5.69 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.128 -0.487 . . . . 1.7 110.645 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.428 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -54.62 -51.65 76.71 Favored Pre-proline 0 CA--C 1.538 0.485 0 CA-C-N 115.512 -0.767 . . . . 0.42999999999999999 112.282 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.428 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 35.5 Cg_endo -66.03 -29.49 48.62 Favored 'Trans proline' 0 C--N 1.356 0.936 0 C-N-CA 121.602 1.535 . . . . 0.5 112.182 179.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.6 tptm -70.58 -45.96 64.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.46 -0.336 . . . . 2.7799999999999998 110.867 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 35.5 m -72.64 -25.79 23.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 120.837 -0.345 . . . . 0.39000000000000001 110.49 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.37 -50.12 49.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 0.32000000000000001 110.655 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -66.67 -35.32 79.86 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 110.207 -0.294 . . . . 1.3999999999999999 110.207 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.618 ' SD ' ' HB3' ' A' ' 8' ' ' PHE . 57.0 ttm -66.48 -40.82 89.52 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.02 0.438 . . . . 1.51 109.839 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -60.29 -49.13 78.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.508 -0.769 . . . . 0.40999999999999998 109.503 178.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -57.39 -46.68 83.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.092 -0.958 . . . . 1.1100000000000001 110.837 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -62.97 -43.89 97.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.801 -0.636 . . . . 1.96 111.413 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.43 ' O ' HG21 ' A' ' 52' ' ' VAL . 81.2 t80 -64.67 -45.14 87.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.884 0.373 . . . . 1.5800000000000001 111.227 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 56.4 mmm -67.4 -22.53 65.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.138 -0.483 . . . . 0.69999999999999996 112.051 -178.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.7 mt -103.72 32.35 3.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.917 0.389 . . . . 0.88 111.579 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 59.3 mtp180 -113.76 144.02 30.64 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 116.364 -0.38 . . . . 2.6899999999999999 110.567 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.35 -16.31 31.18 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.833 2.355 . . . . 0.93999999999999995 112.613 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.05 4.8 21.58 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.014 -0.539 . . . . 1.3300000000000001 111.255 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.43 HG21 ' O ' ' A' ' 46' ' ' TYR . 41.3 t -115.33 120.9 66.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.299 -0.41 . . . . 0.58999999999999997 110.789 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -74.41 155.16 38.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.842 -0.617 . . . . 1.8 110.614 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.65 -36.96 62.67 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 122.876 0.47 . . . . 0.81000000000000005 112.214 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -35.02 78.84 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.961 0.41 . . . . 3.5800000000000001 110.451 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.4 mmm-85 -73.9 -37.21 64.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.079 -0.51 . . . . 3.0499999999999998 110.544 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 78.3 mttt -65.83 -32.25 73.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.049 -0.523 . . . . 0.58999999999999997 109.755 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 32.0 tp -66.48 -40.64 89.41 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.072 -0.714 . . . . 1.26 109.072 178.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.6 mp -68.62 -39.81 80.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.503 -0.771 . . . . 1.54 110.187 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.34 -34.89 90.66 Favored Glycine 0 N--CA 1.452 -0.273 0 N-CA-C 111.58 -0.608 . . . . 0.37 111.58 179.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.2 tt -66.62 -39.97 88.58 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.335 -0.617 . . . . 1.23 109.335 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -61.32 -40.27 93.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.592 -0.731 . . . . 1.3799999999999999 110.823 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.8 tp -62.16 -45.65 92.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.206 -0.452 . . . . 1.45 110.302 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.486 ' O ' HG22 ' A' ' 68' ' ' VAL . 16.0 tmm? -62.93 -47.17 84.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.854 -0.612 . . . . 0.60999999999999999 109.838 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -56.45 -39.11 72.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.51 -0.768 . . . . 1.6899999999999999 111.525 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -69.36 -53.0 21.72 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.004 -0.543 . . . . 1.54 111.447 -179.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 34.4 m -63.39 -32.6 57.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 112.731 0.641 . . . . 1.3999999999999999 112.731 -178.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.486 HG22 ' O ' ' A' ' 64' ' ' MET . 34.5 m -80.07 -31.95 13.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.446 -0.502 . . . . 0.42999999999999999 111.67 -179.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -75.48 -35.74 60.77 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.982 0.42 . . . . 2.02 110.594 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -84.09 -11.65 56.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.209 -0.45 . . . . 2.1000000000000001 111.315 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.6 -23.46 66.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.445 -0.343 . . . . 0.51000000000000001 111.087 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.4 ' HD3' HE22 ' A' ' 80' ' ' GLN . 3.4 mmmp? -66.77 -38.36 86.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.253 -0.431 . . . . 2.0899999999999999 110.386 179.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -73.32 -30.52 62.5 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.923 -0.655 . . . . 0.66000000000000003 111.658 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -81.13 -15.49 55.71 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.817 0.342 . . . . 1.6200000000000001 110.329 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 62.9 mttp 65.1 26.67 12.51 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.446 -0.797 . . . . 2.7000000000000002 110.679 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 36.7 mm -109.68 86.37 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.638 -0.71 . . . . 0.63 109.423 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.409 HG13 ' OE1' ' A' ' 78' ' ' GLN . 2.0 pp -73.11 -12.05 15.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.123 -0.489 . . . . 0.85999999999999999 110.753 -179.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.409 ' OE1' HG13 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -59.74 -35.57 74.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.962 -0.563 . . . . 2.2200000000000002 110.165 179.321 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.51 -43.7 89.25 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.299 0.571 . . . . 1.3400000000000001 109.5 178.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.4 HE22 ' HD3' ' A' ' 72' ' ' LYS . 75.2 mt-30 -68.92 -36.97 78.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.194 -0.912 . . . . 1.3 111.191 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.406 ' O ' ' HG2' ' A' ' 85' ' ' LYS . 30.2 t70 -69.96 -43.95 70.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.901 0.382 . . . . 1.3200000000000001 110.931 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.43 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 39.8 m -62.87 -44.44 96.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.052 -0.522 . . . . 0.93999999999999995 111.193 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -79.22 -33.39 43.76 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-N 116.318 -0.401 . . . . 1.23 111.297 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.15 -44.27 94.9 Favored Glycine 0 N--CA 1.453 -0.226 0 N-CA-C 114.211 0.445 . . . . 0.34000000000000002 114.211 -178.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.43 ' HE2' ' HA ' ' A' ' 82' ' ' SER . 0.0 OUTLIER -66.18 -20.88 66.27 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.204 0.446 . . . . 1.3100000000000001 112.204 -178.772 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 20.4 m -106.41 -17.2 7.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.898 0.38 . . . . 0.38 110.902 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.76 -46.98 85.52 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.131 -0.486 . . . . 0.38 111.011 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.49 -40.43 71.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.254 -0.43 . . . . 0.45000000000000001 110.735 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -66.27 -58.61 4.98 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.805 -0.634 . . . . 1.5600000000000001 110.169 179.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.514 ' O ' HG12 ' A' ' 94' ' ' ILE . 81.7 t -56.02 -49.72 73.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.945 -0.571 . . . . 0.34000000000000002 111.905 -178.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 94.8 mt -59.03 -43.45 91.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.817 -0.174 . . . . 1.45 111.424 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -65.82 -32.29 82.39 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.757 -0.735 . . . . 0.40999999999999998 112.401 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 34.7 mmm-85 -77.55 -52.93 8.24 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.528 0.204 . . . . 3.46 111.245 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.514 HG12 ' O ' ' A' ' 90' ' ' VAL . 37.9 pt -66.97 -18.8 24.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.452 -0.34 . . . . 0.5 111.361 -179.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -61.64 -30.93 71.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.394 0.616 . . . . 1.0 109.812 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -85.74 -14.98 43.62 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.576 -0.738 . . . . 1.1399999999999999 110.375 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -92.11 -38.12 12.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.907 -0.588 . . . . 1.3300000000000001 110.773 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 -67.28 122.03 81.16 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.566 -0.743 . . . . 1.3899999999999999 111.383 -179.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -71.85 -175.88 1.84 Allowed 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.476 2.117 . . . . 1.47 112.337 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 15.9 ptt-85 -55.56 -27.37 48.76 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 113.119 0.785 . . . . 4.8700000000000001 113.119 -178.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.44 ' HA ' ' CE ' ' A' ' 104' ' ' LYS . 33.4 t70 -81.15 -46.09 15.42 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.654 -0.418 . . . . 2.5800000000000001 111.845 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 22.5 mt -73.86 -29.2 61.97 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.363 0.505 . . . . 0.84999999999999998 112.363 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 57.1 pttt -58.85 -28.42 66.06 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.792 0.329 . . . . 2.3599999999999999 111.149 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.44 ' CE ' ' HA ' ' A' ' 101' ' ' ASP . 41.0 mtmt -64.42 -50.91 65.72 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.04 0.448 . . . . 2.5699999999999998 110.599 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 40.9 mttp -68.47 -33.55 74.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.854 -0.612 . . . . 2.4399999999999999 110.093 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 16.6 tp -63.39 -48.26 78.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.717 -0.674 . . . . 1.27 110.641 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.8 p -66.57 -33.57 75.96 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.941 -0.304 . . . . 1.1499999999999999 110.796 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 39.0 mtt180 -64.08 -52.43 59.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.157 -0.474 . . . . 3.6000000000000001 111.472 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.482 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 6.2 p -61.48 -42.17 92.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 121.085 -0.246 . . . . 1.25 110.961 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 50.5 t -60.4 -43.89 94.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 121.017 0.437 . . . . 1.1100000000000001 110.175 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.424 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 2.7 t-20 -60.11 -47.34 86.29 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.589 -0.732 . . . . 1.74 110.693 179.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 78.8 mt -63.59 -44.35 98.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.305 -0.407 . . . . 1.21 111.139 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 87.1 mt -60.28 -44.01 95.73 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.973 0.36 . . . . 1.3300000000000001 111.973 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.424 ' HG3' ' O ' ' A' ' 111' ' ' ASN . 2.0 ptpt -75.1 -35.4 61.76 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.91 -0.316 . . . . 1.6899999999999999 111.506 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -71.07 -27.07 63.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.634 0.255 . . . . 2.2000000000000002 111.282 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 6.4 mtt-85 -90.76 -4.0 57.0 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.67 -0.493 . . . . 3.23 109.67 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 56.09 54.89 7.37 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.089 -0.959 . . . . 2.0 110.16 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 37.8 mm -73.86 -45.83 48.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.344 -0.844 . . . . 0.60999999999999999 110.602 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -100.31 171.53 7.72 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.966 -0.561 . . . . 1.26 110.736 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.8 163.08 20.09 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.931 -0.577 . . . . 1.3 111.224 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.3 mmmp? -55.4 -43.38 75.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 2.8500000000000001 111.683 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.92 -23.05 64.12 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.016 -0.538 . . . . 2.9500000000000002 111.659 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 61.4 t -85.19 -49.18 15.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 121.144 -0.223 . . . . 1.28 111.26 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 27.8 m -61.17 -30.54 48.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.883 0.373 . . . . 1.23 111.181 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -80.84 -28.46 36.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 1.74 110.86 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.45 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 10.9 t70 -73.41 -40.55 64.18 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.017 0.437 . . . . 1.4399999999999999 110.179 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 91.0 mt -60.62 -52.51 60.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.98 -0.555 . . . . 0.46999999999999997 111.526 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -63.11 -33.98 76.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.227 0.454 . . . . 2.0499999999999998 112.227 -178.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 13.1 ptt180 -74.81 -33.81 62.26 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.426 -0.51 . . . . 3.98 110.943 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 39.3 m -66.04 -44.62 84.1 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.983 0.42 . . . . 0.69999999999999996 110.734 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.5 mp -62.04 -36.83 82.77 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.119 -0.491 . . . . 1.3300000000000001 110.447 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.36 -41.15 66.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.785 -0.643 . . . . 0.68999999999999995 110.851 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.05 -34.11 74.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.366 -0.379 . . . . 0.83999999999999997 111.432 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.18 -19.37 63.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.447 . . . . 1.1200000000000001 111.177 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 55.7 mt 53.79 45.01 28.77 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.913 -0.585 . . . . 4.04 111.819 179.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -107.11 35.11 3.15 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.341 0.591 . . . . 6.6399999999999997 109.746 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.736 -0.65 . . . . 8.0 109.893 179.943 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 206' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo . . . . . 0 N--CA 1.482 0.817 0 N-CA-C 111.67 -0.165 . . . . 7.4699999999999998 111.67 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 48.9 m 63.38 102.88 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.982 0.896 . . . . 6.0199999999999996 112.246 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -81.26 130.23 34.94 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.576 -0.738 . . . . 4.0700000000000003 111.128 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 209' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_exo -58.0 -24.13 63.85 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.07 2.513 . . . . 4.3499999999999996 112.715 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 1.5 m -81.4 -8.42 59.73 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.236 0.541 . . . . 4.9500000000000002 110.523 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 10.0 m -134.52 71.44 71.35 Favored Pre-proline 0 C--O 1.236 0.387 0 CA-C-N 116.181 -0.463 . . . . 3.1600000000000001 110.394 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 213' ' ' PRO . . . . . 0.422 ' O ' ' HB2' ' A' ' 19' ' ' GLN . 27.6 Cg_endo -61.67 -42.91 29.33 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.857 2.372 . . . . 4.0300000000000002 112.814 -179.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.304 -0.855 . . . . 5.5700000000000003 108.916 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 120.514 0.197 . . . . 5.4699999999999998 110.797 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -91.67 167.74 11.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.99 0.424 . . . . 5.3399999999999999 110.577 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m -81.79 67.59 7.83 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.273 -0.421 . . . . 2.73 110.504 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.43 -21.48 66.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.039 0.447 . . . . 3.2400000000000002 110.782 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -67.13 -14.94 63.39 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.735 -0.666 . . . . 2.8999999999999999 111.54 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.429 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 97.0 mt-30 -64.34 -31.33 72.49 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.091 0.472 . . . . 2.75 109.737 179.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -72.6 -49.57 31.24 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.86 -0.609 . . . . 0.91000000000000003 110.11 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -36.67 80.21 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.784 -0.644 . . . . 0.85999999999999999 112.015 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.1 t -72.66 -26.95 61.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.455 -0.339 . . . . 1.4199999999999999 110.674 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.429 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 22.6 mmmt -69.37 -27.78 65.62 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-O 120.701 0.286 . . . . 1.3 110.589 179.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.86 -29.87 71.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.956 -0.566 . . . . 1.5700000000000001 110.577 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -81.48 -20.8 39.44 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.054 -0.521 . . . . 1.5900000000000001 110.496 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.2 p -101.16 24.69 9.09 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.066 -0.515 . . . . 1.6299999999999999 111.554 -179.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 15' ' ' LEU . 15.8 mt -77.36 165.44 24.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.037 0.446 . . . . 1.1000000000000001 111.373 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -144.88 168.25 20.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.82 -0.627 . . . . 2.1600000000000001 109.377 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -82.62 -20.85 35.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.663 0.268 . . . . 1.9399999999999999 111.316 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.455 ' HB2' ' OG ' ' A' ' 21' ' ' SER . 3.5 m -61.61 133.87 56.15 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 1.6100000000000001 111.082 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.02 -34.89 79.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.85 -0.614 . . . . 2.6400000000000001 110.554 -178.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -66.15 -38.66 88.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.821 -0.627 . . . . 2.9900000000000002 110.745 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.455 ' OG ' ' HB2' ' A' ' 18' ' ' SER . 4.3 m -68.16 -38.9 82.61 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.147 -0.479 . . . . 1.1000000000000001 110.163 179.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.9 mm -67.32 -34.97 72.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 N-CA-C 109.047 -0.723 . . . . 0.88 109.047 178.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.0 m -63.26 -33.78 76.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.185 -0.916 . . . . 1.1799999999999999 111.179 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.1 m -62.43 -47.58 83.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 1.1599999999999999 110.722 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.35 -40.66 81.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.101 -0.5 . . . . 0.45000000000000001 110.632 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 29.1 t -61.32 -48.89 79.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.025 -0.534 . . . . 1.3200000000000001 110.771 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -26.8 68.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 2.3799999999999999 111.1 -179.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 13.9 t90 -78.15 -37.83 45.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.153 -0.476 . . . . 0.97999999999999998 110.169 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -67.52 -35.4 79.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.669 -0.696 . . . . 1.3 110.911 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.7 -23.9 67.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.408 -0.36 . . . . 1.0600000000000001 111.774 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 68.4 mt -81.09 -20.75 40.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.074 0.464 . . . . 1.71 111.065 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -110.27 41.45 1.74 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.11 0.481 . . . . 1.51 110.443 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 54.6 p90 -59.11 -20.6 54.95 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.802 -0.635 . . . . 1.6100000000000001 112.098 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.3 ttp180 -71.47 -25.49 62.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.034 0.445 . . . . 3.9700000000000002 110.711 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.33 16.97 25.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.897 -0.592 . . . . 1.7 110.739 -179.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.503 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.38 -50.88 77.27 Favored Pre-proline 0 CA--C 1.536 0.404 0 CA-C-N 115.735 -0.666 . . . . 0.42999999999999999 112.51 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 18.1 Cg_endo -59.81 -31.69 94.32 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 121.83 1.687 . . . . 0.5 112.708 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.3 tptt -76.57 -41.22 47.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.318 -0.401 . . . . 2.7799999999999998 111.345 -178.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.1 m -73.17 -29.77 29.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 C-N-CA 120.396 -0.522 . . . . 0.39000000000000001 110.546 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.83 -46.41 71.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.185 -0.461 . . . . 0.32000000000000001 111.34 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 7.4 pt-20 -64.84 -40.78 95.72 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 110.049 -0.352 . . . . 1.3999999999999999 110.049 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 65.7 mtm -65.47 -37.31 86.47 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.961 0.41 . . . . 1.51 109.945 179.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 63.5 t90 -59.55 -48.27 82.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.493 -0.776 . . . . 0.40999999999999998 109.742 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.405 ' HE3' HD12 ' A' ' 48' ' ' LEU . 8.9 ttpt -60.83 -45.07 95.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.209 -0.451 . . . . 1.1100000000000001 110.676 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.536 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 10.0 mm-40 -60.53 -47.09 87.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.963 -0.562 . . . . 1.96 110.851 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -65.43 -44.18 88.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 1.5800000000000001 111.115 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 70.3 mmm -66.16 -22.98 66.39 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.104 0.409 . . . . 0.69999999999999996 112.104 -179.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.405 HD12 ' HE3' ' A' ' 44' ' ' LYS . 51.3 mt -99.68 7.47 45.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.602 0.239 . . . . 0.88 111.487 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.536 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 41.9 mtp180 -84.92 132.57 45.49 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.954 -0.387 . . . . 2.6899999999999999 109.954 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -67.07 -11.69 33.23 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.754 2.303 . . . . 0.93999999999999995 112.59 -179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -16.43 59.24 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.171 0.51 . . . . 1.3300000000000001 110.6 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.2 t -92.18 123.87 44.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.799 -0.637 . . . . 0.58999999999999997 110.769 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -69.61 153.31 43.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.795 -0.639 . . . . 1.8 110.601 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.35 -39.69 64.35 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.017 -0.538 . . . . 0.81000000000000005 112.354 -179.477 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -68.82 -32.6 72.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.845 0.355 . . . . 3.5800000000000001 110.954 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.7 mmt85 -71.45 -32.65 68.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.314 -0.403 . . . . 3.0499999999999998 110.016 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.1 mttt -67.65 -34.29 76.66 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.452 -0.573 . . . . 0.58999999999999997 109.452 178.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 40.8 tp -63.3 -43.64 97.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.773 -0.648 . . . . 1.26 109.797 178.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 94.1 mt -65.47 -40.76 93.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.812 -0.631 . . . . 1.54 110.034 179.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.9 -30.69 78.46 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.983 -0.627 . . . . 0.37 111.743 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 25.8 tp -71.78 -38.82 70.25 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.918 0.389 . . . . 1.23 110.138 178.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -65.96 -31.37 72.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.961 -0.563 . . . . 1.3799999999999999 110.568 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 56.7 tp -65.73 -44.5 85.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.956 -0.565 . . . . 1.45 110.627 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.474 ' HG3' ' N ' ' A' ' 65' ' ' ASN . 0.0 OUTLIER -67.13 -34.61 77.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.60999999999999999 110.841 -179.61 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.474 ' N ' ' HG3' ' A' ' 64' ' ' MET . 11.2 t30 -63.44 -37.29 86.73 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.343 0.592 . . . . 1.6899999999999999 110.528 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -68.22 -52.87 29.3 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.382 -0.826 . . . . 1.54 111.295 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.417 HG12 ' HA ' ' A' ' 64' ' ' MET . 7.1 p -63.43 -39.42 85.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 112.9 0.704 . . . . 1.3999999999999999 112.9 -177.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.465 HG22 ' O ' ' A' ' 64' ' ' MET . 33.5 m -73.57 -24.58 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 C-N-CA 120.416 -0.514 . . . . 0.42999999999999999 111.517 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -75.18 -47.66 27.3 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.111 -0.329 . . . . 2.02 110.111 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -72.08 -23.16 61.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.186 -0.461 . . . . 2.1000000000000001 110.732 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.09 -29.09 70.07 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-N 116.392 -0.367 . . . . 0.51000000000000001 111.125 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.479 ' HD2' ' HA ' ' A' ' 118' ' ' ILE . 42.8 mtpt -68.01 -34.88 77.34 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.441 -0.345 . . . . 2.0899999999999999 110.371 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.46 -30.4 75.08 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.924 -0.655 . . . . 0.66000000000000003 111.753 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -95.62 -2.09 48.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.731 0.3 . . . . 1.6200000000000001 110.447 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm 62.01 23.75 14.04 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.686 -0.688 . . . . 2.7000000000000002 112.121 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 23.3 mm -86.36 78.91 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.861 -0.422 . . . . 0.63 109.861 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 10.3 pt -64.42 -11.71 10.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.861 -0.609 . . . . 0.85999999999999999 111.71 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.96 -26.75 68.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.095 -0.502 . . . . 2.2200000000000002 110.492 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -73.5 -51.23 17.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 1.3400000000000001 110.865 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -63.96 -28.65 69.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 1.3 111.311 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -73.24 -50.28 23.22 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.208 0.527 . . . . 1.3200000000000001 109.968 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.436 ' HA ' ' HE3' ' A' ' 85' ' ' LYS . 23.4 m -64.4 -47.1 80.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.455 -0.793 . . . . 0.93999999999999995 111.65 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -76.77 -30.22 56.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.605 0.24 . . . . 1.23 111.308 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.7 -42.21 93.38 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.078 -0.582 . . . . 0.34000000000000002 113.479 -179.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.436 ' HE3' ' HA ' ' A' ' 82' ' ' SER . 9.7 ptpt -60.55 -27.06 67.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.752 0.276 . . . . 1.3100000000000001 111.539 -179.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.416 HG13 ' HG3' ' A' ' 85' ' ' LYS . 17.1 m -103.29 -14.64 8.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.707 0.289 . . . . 0.38 111.564 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.74 -44.61 93.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.427 -0.351 . . . . 0.38 111.323 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.27 -36.81 69.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.098 0.475 . . . . 0.45000000000000001 111.016 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 5.8 tp10 -72.69 -58.61 3.22 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.598 -0.728 . . . . 1.5600000000000001 110.62 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 96.2 t -54.91 -50.34 62.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.85 -0.614 . . . . 0.34000000000000002 112.107 -178.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.534 HD13 HD11 ' A' ' 94' ' ' ILE . 3.3 mm? -58.24 -42.22 85.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.531 0.205 . . . . 1.45 111.355 -179.119 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -67.66 -35.06 85.24 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.573 -0.823 . . . . 0.40999999999999998 112.426 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 15.8 mmp_? -75.68 -48.76 20.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.548 0.213 . . . . 3.46 111.566 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.534 HD11 HD13 ' A' ' 91' ' ' LEU . 43.5 pt -65.97 -25.46 36.09 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 C-N-CA 121.062 -0.255 . . . . 0.5 111.589 -178.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -63.15 -21.79 66.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.432 0.634 . . . . 1.0 110.189 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -97.27 -33.73 11.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.722 -0.672 . . . . 1.1399999999999999 110.804 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -76.3 -32.83 58.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 1.3300000000000001 111.055 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -80.82 132.83 56.4 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.12 -0.491 . . . . 1.3899999999999999 110.226 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.408 ' HD2' HD12 ' A' ' 102' ' ' LEU . 28.7 Cg_endo -63.42 166.35 15.41 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.352 2.035 . . . . 1.47 110.835 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.483 ' HA ' ' HG2' ' A' ' 103' ' ' LYS . 0.0 OUTLIER -59.44 -21.61 60.28 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.945 0.35 . . . . 4.8700000000000001 111.945 -178.758 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.27 -25.79 51.8 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.831 0.348 . . . . 2.5800000000000001 110.969 179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.408 HD12 ' HD2' ' A' ' 99' ' ' PRO . 26.4 mt -98.66 -26.81 14.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.575 -0.284 . . . . 0.84999999999999998 111.736 -178.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . 0.483 ' HG2' ' HA ' ' A' ' 100' ' ' ARG . 0.0 OUTLIER -61.13 -25.19 66.82 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.002 0.429 . . . . 2.3599999999999999 110.541 -179.87 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.548 ' O ' ' HG3' ' A' ' 108' ' ' ARG . 53.2 mttm -65.48 -35.39 80.77 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.028 -0.533 . . . . 2.5699999999999998 110.216 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 18.5 mtpp -69.94 -49.89 47.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.945 -0.57 . . . . 2.4399999999999999 110.925 -179.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.478 ' CD2' ' HA ' ' A' ' 103' ' ' LYS . 3.2 pp -65.78 -27.92 68.63 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.684 0.278 . . . . 1.27 110.657 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.1 t -63.78 -37.64 88.13 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.265 -0.425 . . . . 1.1499999999999999 110.03 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 104' ' ' LYS . 8.3 mtp85 -66.42 -40.66 89.69 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.423 -0.584 . . . . 3.6000000000000001 109.423 179.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.583 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 47.3 t -59.56 -56.95 13.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.159 -0.928 . . . . 1.25 110.732 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 44.7 t -57.85 -41.19 79.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.078 -0.51 . . . . 1.1100000000000001 111.13 -179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -58.92 -49.08 79.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.301 -0.409 . . . . 1.74 110.524 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 96.9 mt -65.18 -38.3 82.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.712 0.291 . . . . 1.21 110.685 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 96.0 mt -59.67 -43.21 94.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.312 -0.404 . . . . 1.3300000000000001 111.231 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -79.94 -33.25 39.81 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.899 -0.321 . . . . 1.6899999999999999 111.07 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -66.0 -44.7 84.01 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.717 0.294 . . . . 2.2000000000000002 111.022 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 85.8 mtt180 -87.03 7.27 28.44 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.548 -0.296 . . . . 3.23 111.103 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 47.84 58.89 4.59 Favored 'General case' 0 C--O 1.235 0.315 0 O-C-N 123.77 0.669 . . . . 2.0 110.84 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.479 ' HA ' ' HD2' ' A' ' 72' ' ' LYS . 40.4 mm -73.65 -48.02 42.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.855 -0.612 . . . . 0.60999999999999999 110.939 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -101.93 174.76 5.8 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.024 -0.535 . . . . 1.26 110.838 -179.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . 0.42 ' O ' HG23 ' A' ' 124' ' ' VAL . 26.7 t -71.18 139.6 50.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.058 -0.519 . . . . 1.3 109.761 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -53.23 -30.35 37.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.417 -0.356 . . . . 2.8500000000000001 111.712 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 6.1 mm100 -61.92 -49.48 76.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.93 0.395 . . . . 2.9500000000000002 111.132 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.533 ' O ' HG13 ' A' ' 127' ' ' ILE . 3.9 p -79.22 -27.89 13.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.301 -0.409 . . . . 1.28 111.032 -179.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 120' ' ' SER . 43.3 t -60.98 -42.21 92.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.206 0.527 . . . . 1.23 109.81 179.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -61.88 -37.89 86.27 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.442 -0.799 . . . . 1.74 110.391 179.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -67.35 -36.48 81.5 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.142 -0.481 . . . . 1.4399999999999999 110.452 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 123' ' ' VAL . 70.1 mt -63.58 -49.33 82.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.084 0.469 . . . . 0.46999999999999997 109.832 178.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -62.06 -40.1 94.64 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.743 -0.662 . . . . 2.0499999999999998 110.544 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 41.7 mmt-85 -62.1 -43.47 98.77 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.255 -0.43 . . . . 3.98 110.354 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 50.7 m -64.44 -37.65 88.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.727 -0.67 . . . . 0.69999999999999996 110.783 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 127' ' ' ILE . 73.5 mt -66.43 -46.01 77.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.35 -0.386 . . . . 1.3300000000000001 110.88 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.443 ' O ' ' HG3' ' A' ' 136' ' ' GLU . . . -68.14 -29.82 68.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 0.68999999999999995 111.021 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.77 -21.77 64.85 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.028 -0.533 . . . . 0.83999999999999997 111.727 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -73.82 -18.67 60.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.421 . . . . 1.1200000000000001 111.108 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.65 20.99 10.19 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.886 0.374 . . . . 4.04 111.063 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 132' ' ' ALA . 65.9 mt-10 -82.98 -4.89 58.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.158 0.504 . . . . 6.6399999999999997 110.351 179.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 81.1 t60 . . . . . 0 C--O 1.244 0.8 0 CA-C-O 118.141 -0.933 . . . . 8.0 109.239 179.225 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 206' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_exo . . . . . 0 N--CA 1.475 0.431 0 N-CA-C 112.679 0.223 . . . . 7.4699999999999998 112.679 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 49.4 m 65.05 98.02 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.413 0.625 . . . . 6.0199999999999996 111.552 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -53.98 123.06 11.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.099 -0.5 . . . . 4.0700000000000003 111.63 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 209' ' ' SEP . . . . . 0.417 ' HA ' ' HD3' ' B' ' 210' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' B' ' 209' ' ' SEP . 35.6 Cg_exo -60.2 -25.74 80.8 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.743 2.295 . . . . 4.3499999999999996 112.552 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.83 2.64 56.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.267 0.556 . . . . 4.9500000000000002 111.104 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 6.7 m -144.51 81.07 11.4 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 116.18 -0.463 . . . . 3.1600000000000001 109.777 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 213' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -70.39 -55.31 0.16 Allowed 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.42 2.08 . . . . 4.0300000000000002 113.258 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.199 0 CA-C-O 118.03 -0.986 . . . . 5.5700000000000003 110.241 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.927 0 CA-C-O 120.739 0.305 . . . . 5.4699999999999998 110.541 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -116.67 152.65 33.82 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.123 -0.49 . . . . 5.3399999999999999 110.066 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.6 m -141.78 95.23 2.78 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.866 0.365 . . . . 2.73 110.607 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.9 m -75.17 -19.33 59.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.867 -0.606 . . . . 3.2400000000000002 109.794 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -84.57 16.1 3.39 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.64 -0.709 . . . . 2.8999999999999999 110.151 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.417 ' O ' HG22 ' A' ' 10' ' ' THR . 9.8 pt20 -60.05 -33.22 71.76 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.706 -0.679 . . . . 2.75 111.252 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -75.16 -43.0 54.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.979 0.418 . . . . 0.91000000000000003 110.052 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.97 -39.16 93.85 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.978 -0.556 . . . . 0.85999999999999999 111.438 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.417 HG22 ' O ' ' A' ' 7' ' ' GLN . 1.2 t -69.83 -24.12 63.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.45 -0.341 . . . . 1.4199999999999999 110.783 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -71.9 -36.83 70.14 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 109.996 -0.372 . . . . 1.3 109.996 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -68.08 -26.99 66.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.951 -0.568 . . . . 1.5700000000000001 110.508 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -70.28 -34.34 72.66 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.742 -0.663 . . . . 1.5900000000000001 110.464 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.6 t -105.2 17.19 24.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.903 -0.59 . . . . 1.6299999999999999 110.442 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.2 126.88 31.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.863 -0.608 . . . . 1.1000000000000001 110.291 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -115.29 151.99 33.56 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.663 -0.699 . . . . 2.1600000000000001 109.557 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -80.19 40.53 0.49 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.506 0.67 . . . . 1.9399999999999999 111.119 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.532 ' O ' HG12 ' A' ' 22' ' ' ILE . 3.5 m -107.18 146.66 31.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.561 -0.745 . . . . 1.6100000000000001 110.063 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.1 -32.96 74.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.066 -0.515 . . . . 2.6400000000000001 110.16 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -66.59 -49.67 65.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.069 -0.514 . . . . 2.9900000000000002 109.838 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.46 ' OG ' ' HB2' ' A' ' 18' ' ' SER . 1.2 m -56.6 -48.77 76.71 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.905 -0.588 . . . . 1.1000000000000001 111.777 -179.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.532 HG12 ' O ' ' A' ' 18' ' ' SER . 9.4 mm -64.44 -45.8 94.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.577 -0.283 . . . . 0.88 110.979 -179.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.7 m -66.4 -39.44 89.03 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 111.827 0.306 . . . . 1.1799999999999999 111.827 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.0 t -59.64 -47.33 86.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.064 0.459 . . . . 1.1599999999999999 110.152 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.36 -34.0 72.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.968 -0.56 . . . . 0.45000000000000001 110.799 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.5 t -59.06 -52.67 64.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.175 -0.466 . . . . 1.3200000000000001 110.283 179.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.7 mmtp -62.97 -37.95 89.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.093 -0.503 . . . . 2.3799999999999999 110.395 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 20.6 t90 -61.7 -39.05 90.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.505 -0.77 . . . . 0.97999999999999998 110.303 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 29' ' ' LEU . 2.2 mm? -74.05 -42.23 60.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.715 -0.675 . . . . 1.3 110.515 179.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 mp -59.85 -23.26 63.24 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.093 -0.503 . . . . 1.0600000000000001 111.585 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 78.3 mt -75.82 -32.04 59.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.458 -0.337 . . . . 1.71 110.528 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -103.08 48.12 0.86 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.58 0.705 . . . . 1.51 110.168 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.442 ' HA ' ' CE2' ' A' ' 79' ' ' PHE . 34.0 p90 -57.89 -23.24 52.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.259 -0.882 . . . . 1.6100000000000001 112.09 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.7 mtp-105 -71.75 -18.73 62.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.912 0.387 . . . . 3.9700000000000002 111.143 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.04 21.72 16.86 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.941 0.4 . . . . 1.7 110.817 -179.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.478 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.26 -49.45 84.9 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 115.446 -0.797 . . . . 0.42999999999999999 112.521 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.588 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 35.3 Cg_endo -65.46 -34.56 42.66 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 121.548 1.499 . . . . 0.5 112.745 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.4 ttmt -66.47 -47.04 74.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.677 0.275 . . . . 2.7799999999999998 111.688 -179.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.445 ' HA ' ' SD ' ' A' ' 42' ' ' MET . 26.9 m -73.14 -22.93 19.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 C-N-CA 120.777 -0.369 . . . . 0.39000000000000001 111.053 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.427 ' HA ' ' CE1' ' A' ' 83' ' ' PHE . . . -71.94 -50.1 31.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.391 -0.368 . . . . 0.32000000000000001 111.029 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 5.0 pt-20 -63.69 -44.32 94.05 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.347 -0.388 . . . . 1.3999999999999999 111.283 -179.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.445 ' SD ' ' HA ' ' A' ' 39' ' ' VAL . 16.5 ptm -65.88 -33.44 75.85 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.484 0.183 . . . . 1.51 110.915 -179.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 64.7 t90 -64.94 -45.49 85.56 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.158 -0.682 . . . . 0.40999999999999998 109.158 178.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.479 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 16.9 ttpt -60.16 -49.5 77.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.277 -0.874 . . . . 1.1100000000000001 110.426 179.293 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.519 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 6.7 mm-40 -58.48 -42.51 87.71 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.04 0.448 . . . . 1.96 110.58 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -63.66 -42.75 98.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.761 -0.654 . . . . 1.5800000000000001 111.217 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 71.6 mmm -72.74 -23.6 60.86 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.129 -0.487 . . . . 0.69999999999999996 112.311 -178.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 71.0 mt -85.27 -16.8 38.92 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 111.942 0.349 . . . . 0.88 111.942 -179.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 57.0 mtm180 -70.67 133.85 86.48 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.737 0.304 . . . . 2.6899999999999999 111.401 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.2 -13.63 20.95 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.858 2.372 . . . . 0.93999999999999995 112.37 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -9.68 58.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.988 -0.551 . . . . 1.3300000000000001 110.793 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 34.0 t -104.63 125.81 59.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.796 -0.638 . . . . 0.58999999999999997 109.743 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -72.74 163.28 28.35 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.057 0.456 . . . . 1.8 111.005 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.22 -34.44 73.66 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.123 0.786 . . . . 0.81000000000000005 113.123 -178.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -62.6 -43.92 97.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.769 0.319 . . . . 3.5800000000000001 110.68 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -65.28 -37.38 87.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 3.0499999999999998 110.359 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -65.77 -36.15 82.74 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.908 -0.587 . . . . 0.58999999999999997 110.327 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 32.9 tp -62.85 -41.32 99.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.125 -0.489 . . . . 1.26 110.032 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.4 mp -69.39 -35.98 76.32 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.03 -0.532 . . . . 1.54 110.16 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.11 -32.46 84.12 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.758 -0.734 . . . . 0.37 111.313 178.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 37.2 tp -68.16 -37.13 80.67 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.97 0.414 . . . . 1.23 110.218 179.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -64.57 -39.47 93.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.842 -0.617 . . . . 1.3799999999999999 110.499 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.0 tp -63.67 -44.61 93.26 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.082 -0.508 . . . . 1.45 110.481 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.429 ' O ' HG22 ' A' ' 68' ' ' VAL . 13.6 tmm? -60.13 -41.58 92.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.013 -0.54 . . . . 0.60999999999999999 109.763 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.505 ' O ' ' HB2' ' A' ' 69' ' ' GLN . 1.4 t30 -60.05 -41.74 92.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.601 -0.727 . . . . 1.6899999999999999 111.301 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -67.79 -47.72 68.32 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.114 0.413 . . . . 1.54 112.114 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 31.1 m -63.33 -32.13 55.35 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 112.669 0.618 . . . . 1.3999999999999999 112.669 -178.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.429 HG22 ' O ' ' A' ' 64' ' ' MET . 34.2 m -88.59 -18.96 7.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.613 -0.435 . . . . 0.42999999999999999 111.09 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.505 ' HB2' ' O ' ' A' ' 65' ' ' ASN . 6.2 tp-100 -76.77 -49.35 16.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 2.02 110.831 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 55.4 mm-40 -82.16 -6.15 58.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.185 -0.461 . . . . 2.1000000000000001 111.035 -179.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.3 -33.47 72.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.317 -0.401 . . . . 0.51000000000000001 111.519 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -67.02 -28.68 68.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.65 -0.25 . . . . 2.0899999999999999 111.24 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.56 -38.53 95.83 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.918 -0.658 . . . . 0.66000000000000003 111.93 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -100.57 0.82 40.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.653 0.263 . . . . 1.6200000000000001 110.743 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? 63.02 37.75 11.47 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.824 -0.626 . . . . 2.7000000000000002 111.009 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.4 mm -92.32 81.86 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.367 0.603 . . . . 0.63 109.755 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 44.1 pt -73.78 -11.37 14.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.616 -0.72 . . . . 0.85999999999999999 111.249 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -61.8 -47.57 84.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.11 -0.496 . . . . 2.2200000000000002 110.628 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.442 ' CE2' ' HA ' ' A' ' 33' ' ' TYR . 8.7 m-85 -64.92 -33.96 77.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.303 -0.408 . . . . 1.3400000000000001 111.214 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -71.58 -26.49 62.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.989 -0.551 . . . . 1.3 111.32 -179.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -87.26 -41.92 13.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.723 0.297 . . . . 1.3200000000000001 110.542 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.457 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 35.0 p -67.3 -52.52 39.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.326 -0.397 . . . . 0.93999999999999995 111.001 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.427 ' CE1' ' HA ' ' A' ' 40' ' ' ALA . 18.9 m-85 -74.31 -31.54 62.52 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.323 -0.398 . . . . 1.23 110.712 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -63.14 -43.64 98.37 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.166 -0.54 . . . . 0.34000000000000002 113.39 -179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.457 ' HE2' ' HA ' ' A' ' 82' ' ' SER . 0.1 OUTLIER -65.47 -24.79 67.25 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.254 0.465 . . . . 1.3100000000000001 112.254 -178.627 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.7 m -104.77 -9.86 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 C-N-CA 120.894 -0.322 . . . . 0.38 111.364 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.22 -48.73 80.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.267 -0.424 . . . . 0.38 111.432 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.04 -41.76 88.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.157 -0.474 . . . . 0.45000000000000001 111.359 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -62.33 -50.31 72.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.888 -0.596 . . . . 1.5600000000000001 110.464 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 92.9 t -65.32 -41.31 91.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.957 -0.565 . . . . 0.34000000000000002 110.936 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -60.87 -48.29 82.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.501 -0.318 . . . . 1.45 111.101 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -64.9 -25.47 70.69 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.589 -0.815 . . . . 0.40999999999999998 111.879 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.599 ' O ' ' HG2' ' A' ' 96' ' ' GLN . 3.8 mmm-85 -78.87 -51.75 9.26 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.435 0.16 . . . . 3.46 111.21 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 46.2 pt -68.09 -22.26 27.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.926 -0.31 . . . . 0.5 111.241 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -65.51 -28.06 68.92 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.927 0.394 . . . . 1.0 110.742 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.599 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 10.0 pt20 -98.49 -11.84 21.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.031 0.443 . . . . 1.1399999999999999 110.767 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -91.43 -37.61 13.09 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.153 -0.476 . . . . 1.3300000000000001 110.628 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -72.99 130.2 85.36 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.265 -0.425 . . . . 1.3899999999999999 109.933 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -52.55 -77.1 0.02 OUTLIER 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 123.317 2.678 . . . . 1.47 113.298 -179.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -155.8 -53.94 0.09 Allowed 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 111.905 0.335 . . . . 4.8700000000000001 111.905 179.478 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -65.24 -33.38 75.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.038 0.447 . . . . 2.5800000000000001 110.838 -179.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 79.5 mt -74.13 -39.01 63.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.174 -0.466 . . . . 0.84999999999999998 110.875 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . 0.479 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 10.6 ptpt -73.11 -8.75 57.14 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 121.336 0.589 . . . . 2.3599999999999999 110.392 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -81.05 -10.76 59.64 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.361 -0.836 . . . . 2.5699999999999998 109.539 178.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -95.26 -30.06 14.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.722 -0.672 . . . . 2.4399999999999999 111.308 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 103' ' ' LYS . 4.2 pp -69.78 -28.27 65.62 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 121.056 0.455 . . . . 1.27 110.233 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.04 -34.57 76.71 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.979 -0.555 . . . . 1.1499999999999999 110.126 179.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 108' ' ' ARG . 40.0 mmt180 -66.57 -51.62 54.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.556 -0.747 . . . . 3.6000000000000001 111.051 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.453 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 2.7 p -65.28 -40.26 88.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.423 -0.353 . . . . 1.25 110.699 -179.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 6.3 t -62.5 -42.8 97.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.864 0.364 . . . . 1.1100000000000001 110.046 179.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -59.26 -47.83 83.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.866 -0.607 . . . . 1.74 109.953 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.437 ' O ' ' HG2' ' A' ' 116' ' ' ARG . 96.8 mt -60.7 -49.72 83.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.996 -0.547 . . . . 1.21 111.335 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 109' ' ' VAL . 96.0 mt -59.87 -39.15 84.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.331 -0.395 . . . . 1.3300000000000001 111.963 -178.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 4.7 pttp -82.23 -22.93 35.63 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.549 -0.46 . . . . 1.6899999999999999 111.769 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -78.79 -37.0 41.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.923 0.392 . . . . 2.2000000000000002 110.48 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 13.4 mmm-85 -84.67 1.37 46.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.083 -0.508 . . . . 3.23 110.288 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 11.5 m120 57.79 47.79 14.84 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.435 -0.802 . . . . 2.0 111.034 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 31.6 mm -70.17 -50.45 47.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.907 -0.588 . . . . 0.60999999999999999 109.801 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -100.38 158.79 15.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.901 -0.591 . . . . 1.26 110.309 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.8 m -67.32 156.02 37.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.194 -0.457 . . . . 1.3 109.945 179.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 61.3 mtpt -55.77 -34.29 65.12 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.945 0.35 . . . . 2.8500000000000001 111.945 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -59.54 -41.83 90.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.184 0.516 . . . . 2.9500000000000002 110.02 179.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.429 ' O ' HG13 ' A' ' 127' ' ' ILE . 40.7 t -72.27 -45.01 62.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.578 -0.737 . . . . 1.28 110.301 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 76.8 t -57.87 -44.07 85.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.496 . . . . 1.23 110.932 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 42.4 t-20 -58.01 -45.76 86.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.923 -0.58 . . . . 1.74 110.259 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -62.96 -38.82 92.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.984 -0.553 . . . . 1.4399999999999999 111.305 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 123' ' ' VAL . 79.9 mt -66.75 -46.67 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.091 0.472 . . . . 0.46999999999999997 110.775 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 68.5 mt-10 -63.17 -28.86 70.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.151 -0.477 . . . . 2.0499999999999998 110.952 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 21.5 mtm-85 -81.11 -41.08 23.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.24 -0.437 . . . . 3.98 111.984 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 1.2 p -62.71 -33.72 75.69 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.002 0.43 . . . . 0.69999999999999996 110.654 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.6 mp -68.5 -44.25 75.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.169 -0.469 . . . . 1.3300000000000001 110.401 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.84 -37.83 76.29 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.044 -0.526 . . . . 0.68999999999999995 111.735 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.432 ' O ' ' HG2' ' A' ' 136' ' ' GLU . . . -64.44 -19.43 65.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.936 0.398 . . . . 0.83999999999999997 111.426 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -85.14 -5.94 59.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.109 -0.496 . . . . 1.1200000000000001 111.281 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.7 pp -132.13 19.09 4.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.857 0.361 . . . . 4.04 111.318 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 133' ' ' ALA . 4.4 pt-20 -81.45 -27.82 34.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.147 0.498 . . . . 6.6399999999999997 110.175 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 20.8 t-80 . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.506 -0.759 . . . . 8.0 110.15 179.95 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 206' ' ' PRO . . . . . 0.496 ' HD2' ' OG ' ' A' ' 18' ' ' SER . 12.2 Cg_exo . . . . . 0 C--O 1.235 0.326 0 CA-C-O 120.722 0.218 . . . . 7.4699999999999998 111.721 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 3.7 m 59.59 82.88 0.14 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.016 -0.538 . . . . 6.0199999999999996 112.274 178.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . 0.4 ' CE1' ' HA ' ' B' ' 213' ' ' PRO . 89.8 t80 -78.8 130.1 35.34 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 122.226 -0.296 . . . . 4.0700000000000003 110.34 179.259 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 209' ' ' SEP . . . . . 0.415 ' HA ' ' HD3' ' B' ' 210' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' B' ' 209' ' ' SEP . 33.1 Cg_exo -60.35 -27.32 84.64 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.536 2.157 . . . . 4.3499999999999996 112.235 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.62 3.16 38.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.98 -0.555 . . . . 4.9500000000000002 111.006 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 16.8 m -149.1 83.73 6.55 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 116.399 -0.364 . . . . 3.1600000000000001 110.559 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 213' ' ' PRO . . . . . 0.4 ' HA ' ' CE1' ' B' ' 208' ' ' TYR . 43.5 Cg_endo -69.76 -12.48 32.99 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.469 2.113 . . . . 4.0300000000000002 112.097 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.102 0 CA-C-N 115.615 -0.721 . . . . 5.5700000000000003 110.319 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.877 0 CA-C-O 120.635 0.255 . . . . 5.4699999999999998 110.586 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -113.46 -7.33 13.44 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.245 0.545 . . . . 5.3399999999999999 110.362 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.2 m -79.15 79.23 5.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.915 -0.584 . . . . 2.73 111.085 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.44 ' O ' ' HG2' ' A' ' 6' ' ' GLU . 1.0 OUTLIER -71.58 108.22 4.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.926 -0.579 . . . . 3.2400000000000002 110.454 179.692 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.493 ' HA ' ' SD ' ' A' ' 42' ' ' MET . 0.5 OUTLIER 36.12 50.4 0.7 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.182 0.993 . . . . 2.8999999999999999 112.659 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.535 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 19.8 mm100 -69.4 -17.37 63.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.056 -0.52 . . . . 2.75 110.644 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.521 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 78.5 t80 -79.93 -42.58 23.77 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.923 -0.581 . . . . 0.91000000000000003 109.693 179.114 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.1 m -65.34 -34.54 78.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.65 -0.705 . . . . 0.85999999999999999 111.494 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.07 -35.53 81.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.003 0.43 . . . . 1.4199999999999999 110.719 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.535 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 31.1 mmmt -76.23 -38.81 55.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.056 -0.52 . . . . 1.3 110.584 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -60.97 -29.03 69.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.25 -0.432 . . . . 1.5700000000000001 111.499 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 -83.76 -5.97 59.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.309 -0.405 . . . . 1.5900000000000001 111.855 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.6 t -115.81 -3.27 12.23 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.669 -0.412 . . . . 1.6299999999999999 111.44 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.408 HD21 ' HB2' ' A' ' 25' ' ' ALA . 32.5 mt -72.93 163.07 28.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.52 -0.309 . . . . 1.1000000000000001 111.03 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -143.67 -170.26 3.26 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.708 -0.479 . . . . 2.1600000000000001 109.708 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' B' ' 208' ' ' TYR . 1.1 t70 -76.67 -19.28 57.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.198 0.523 . . . . 1.9399999999999999 110.379 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.521 ' HA ' ' CB ' ' B' ' 206' ' ' PRO . 0.0 OUTLIER -54.56 116.88 2.91 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.587 -0.733 . . . . 1.6100000000000001 110.782 179.754 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.47 ' OE1' ' HA ' ' B' ' 208' ' ' TYR . 0.2 OUTLIER -55.47 -35.22 65.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.769 -0.651 . . . . 2.6400000000000001 110.784 -179.485 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -65.7 -34.09 77.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.853 -0.612 . . . . 2.9900000000000002 110.967 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.5 p -71.41 -40.11 70.69 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.575 -0.528 . . . . 1.1000000000000001 109.575 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.1 mm -66.59 -44.18 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 CA-C-N 115.91 -0.587 . . . . 0.88 109.77 179.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 56.0 m -59.58 -38.01 80.02 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.971 -0.559 . . . . 1.1799999999999999 111.173 179.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.3 m -67.9 -28.69 67.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.809 0.338 . . . . 1.1599999999999999 110.832 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.408 ' HB2' HD21 ' A' ' 15' ' ' LEU . . . -82.78 -44.26 15.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.255 -0.43 . . . . 0.45000000000000001 111.113 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.4 p -62.44 -44.01 97.45 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.726 0.298 . . . . 1.3200000000000001 110.651 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -64.66 -36.96 85.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.982 0.42 . . . . 2.3799999999999999 110.536 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -67.44 -36.16 80.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.267 0.556 . . . . 0.97999999999999998 109.539 178.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -70.86 -39.41 72.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.715 -0.675 . . . . 1.3 110.559 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.0 mt -62.28 -24.91 67.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.303 -0.408 . . . . 1.0600000000000001 110.739 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 24.0 mt -78.55 -16.38 57.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.99 -0.55 . . . . 1.71 111.338 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -120.58 46.5 1.98 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.075 0.464 . . . . 1.51 110.659 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -62.81 -9.69 10.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 1.6100000000000001 111.386 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 77.5 mtt180 -66.28 -35.42 80.34 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.218 0.532 . . . . 3.9700000000000002 110.088 178.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -103.79 27.63 7.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.617 -0.719 . . . . 1.7 110.86 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.478 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.51 -51.32 74.15 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.736 -0.665 . . . . 0.42999999999999999 111.852 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.478 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 33.4 Cg_endo -64.5 -28.64 61.92 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 121.617 1.544 . . . . 0.5 112.089 179.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.1 tppt? -72.77 -46.27 54.27 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.023 -0.535 . . . . 2.7799999999999998 111.185 -179.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 35.5 m -72.19 -25.23 23.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 C-N-CA 120.924 -0.311 . . . . 0.39000000000000001 110.521 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.01 -49.2 62.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 0.32000000000000001 110.494 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -68.91 -33.87 74.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.986 -0.552 . . . . 1.3999999999999999 110.098 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.521 ' SD ' ' HB3' ' A' ' 8' ' ' PHE . 39.2 ttm -66.41 -40.05 89.34 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.935 -0.575 . . . . 1.51 109.916 179.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 51.5 t90 -62.48 -47.33 84.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.493 -0.776 . . . . 0.40999999999999998 109.566 178.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 38.9 tttt -56.62 -47.71 79.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.384 -0.826 . . . . 1.1100000000000001 110.802 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.579 ' O ' ' HG2' ' A' ' 49' ' ' ARG . 12.4 mm-40 -57.95 -44.68 87.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.044 -0.526 . . . . 1.96 111.304 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -66.18 -44.46 83.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 1.5800000000000001 111.353 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 84.8 mmm -66.32 -29.62 69.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.303 -0.408 . . . . 0.69999999999999996 111.577 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.2 mt -92.73 19.4 7.55 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.796 0.331 . . . . 0.88 111.365 -179.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.579 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 36.1 mmt-85 -87.08 133.88 38.04 Favored Pre-proline 0 C--N 1.328 -0.353 0 N-CA-C 110.011 -0.366 . . . . 2.6899999999999999 110.011 178.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -74.34 -22.34 16.47 Favored 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.51 2.14 . . . . 0.93999999999999995 112.397 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.3 m -83.3 -16.18 47.23 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.244 -0.435 . . . . 1.3300000000000001 111.456 -179.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.6 t -77.76 127.36 38.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.122 0.486 . . . . 0.58999999999999997 110.794 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -66.55 149.13 50.91 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.437 -0.801 . . . . 1.8 111.137 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.48 -39.46 70.43 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.097 0.406 . . . . 0.81000000000000005 112.097 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 42.0 mtm105 -67.82 -29.73 68.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.877 0.37 . . . . 3.5800000000000001 110.682 -179.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -69.3 -36.67 77.26 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.642 -0.503 . . . . 3.0499999999999998 109.642 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 50.8 mttt -70.03 -33.15 71.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.695 -0.684 . . . . 0.58999999999999997 109.291 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 19.9 tp -62.66 -41.01 98.83 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.667 -0.697 . . . . 1.26 109.811 178.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.9 mp -67.64 -36.99 81.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.468 -0.787 . . . . 1.54 109.997 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.17 -30.19 75.36 Favored Glycine 0 C--N 1.331 0.293 0 CA-C-N 115.802 -0.635 . . . . 0.37 111.604 179.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 8.3 mt -63.84 -44.63 92.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.882 0.372 . . . . 1.23 110.216 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -62.56 -39.22 92.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.672 -0.695 . . . . 1.3799999999999999 110.548 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -61.25 -48.87 79.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.94 -0.573 . . . . 1.45 110.618 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.401 ' O ' HG12 ' A' ' 67' ' ' VAL . 14.7 tmm? -62.38 -48.56 79.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 0.60999999999999999 110.295 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -58.5 -41.59 85.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.794 -0.639 . . . . 1.6899999999999999 111.382 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -68.03 -47.72 67.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.157 -0.474 . . . . 1.54 111.612 -179.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.401 HG12 ' O ' ' A' ' 64' ' ' MET . 8.2 p -64.28 -36.29 76.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 112.645 0.609 . . . . 1.3999999999999999 112.645 -177.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 64' ' ' MET . 35.7 m -78.27 -26.07 14.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 C-N-CA 120.726 -0.39 . . . . 0.42999999999999999 111.28 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -52.07 20.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.018 0.437 . . . . 2.02 109.848 179.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 26.6 mm100 -72.27 -15.21 61.91 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.058 -0.519 . . . . 2.1000000000000001 110.925 -179.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.79 -25.68 68.02 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.261 -0.427 . . . . 0.51000000000000001 110.56 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.507 ' HG2' ' NE2' ' A' ' 80' ' ' GLN . 19.5 mtpt -70.63 -21.04 62.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.335 -0.393 . . . . 2.0899999999999999 110.443 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.21 -43.69 31.44 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.967 -0.635 . . . . 0.66000000000000003 112.177 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -91.47 -0.85 57.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.742 0.306 . . . . 1.6200000000000001 110.616 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp 62.98 46.09 4.99 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.429 -0.805 . . . . 2.7000000000000002 111.132 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 31.9 mm -95.89 78.7 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.921 -0.582 . . . . 0.63 110.124 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.571 ' HA ' ' OE1' ' A' ' 80' ' ' GLN . 15.4 pt -68.51 -16.3 20.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.713 -0.676 . . . . 0.85999999999999999 110.295 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -61.48 -37.9 85.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.542 -0.754 . . . . 2.2200000000000002 110.541 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.43 ' O ' ' HB2' ' A' ' 83' ' ' PHE . 0.8 OUTLIER -72.42 -42.13 65.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.017 -0.538 . . . . 1.3400000000000001 111.173 -179.406 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.571 ' OE1' ' HA ' ' A' ' 77' ' ' ILE . 21.6 mt-30 -68.94 -27.47 65.77 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.081 -0.509 . . . . 1.3 111.511 -178.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.56 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 5.6 t70 -76.02 -49.21 18.23 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.97 0.415 . . . . 1.3200000000000001 110.125 178.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.7 p -67.64 -49.15 64.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.022 -0.535 . . . . 0.93999999999999995 111.516 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.43 ' HB2' ' O ' ' A' ' 79' ' ' PHE . 4.4 m-85 -71.36 -30.7 66.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.59 -0.277 . . . . 1.23 111.239 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.85 -52.03 54.93 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.107 -0.568 . . . . 0.34000000000000002 113.785 -179.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.56 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 10.0 ptpt -60.26 -36.67 78.32 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.072 0.397 . . . . 1.3100000000000001 112.072 -178.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.8 m -82.8 -28.01 8.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 C-N-CA 120.667 -0.413 . . . . 0.38 111.124 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 91' ' ' LEU . . . -62.14 -41.2 98.03 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.639 -0.255 . . . . 0.38 110.934 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.09 -33.9 69.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.028 0.442 . . . . 0.45000000000000001 111.125 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -83.39 -52.46 6.51 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.909 -0.587 . . . . 1.5600000000000001 110.873 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.508 ' O ' HG12 ' A' ' 94' ' ' ILE . 75.7 t -57.56 -50.83 75.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.093 -0.503 . . . . 0.34000000000000002 111.997 -178.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.414 ' HB2' ' O ' ' A' ' 87' ' ' ALA . 8.5 mp -61.52 -38.52 87.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.692 -0.231 . . . . 1.45 111.087 -178.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -70.88 -28.82 70.02 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.506 -0.854 . . . . 0.40999999999999998 112.005 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.535 ' O ' ' HG2' ' A' ' 96' ' ' GLN . 1.3 mmm-85 -78.02 -51.45 10.32 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.646 0.26 . . . . 3.46 111.063 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.508 HG12 ' O ' ' A' ' 90' ' ' VAL . 32.8 pt -70.78 -15.85 19.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.523 -0.308 . . . . 0.5 111.615 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -58.19 -34.16 70.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.018 0.437 . . . . 1.0 110.675 179.301 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.535 ' HG2' ' O ' ' A' ' 93' ' ' ARG . 4.3 pt20 -96.56 1.74 51.64 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.155 -0.475 . . . . 1.1399999999999999 110.799 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -100.67 -31.23 11.32 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.15 0.5 . . . . 1.3300000000000001 109.965 179.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -81.67 131.76 56.82 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.518 -0.765 . . . . 1.3899999999999999 111.11 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -65.1 167.6 15.8 Favored 'Trans proline' 0 CA--C 1.529 0.271 0 C-N-CA 122.699 2.266 . . . . 1.47 111.724 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 13.3 mmm180 -47.82 -40.57 21.51 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.852 0.686 . . . . 4.8700000000000001 112.852 -179.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -71.53 -47.81 52.76 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.002 0.371 . . . . 2.5800000000000001 112.002 -179.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 30.7 mt -70.94 -39.59 72.54 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.857 0.317 . . . . 0.84999999999999998 111.857 -178.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . 0.405 ' HB2' ' HE3' ' A' ' 103' ' ' LYS . 15.3 ptmt -71.15 -17.73 62.54 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.766 -0.374 . . . . 2.3599999999999999 110.629 -179.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -67.22 -34.38 77.35 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.182 -1.044 . . . . 2.5699999999999998 108.182 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.42 ' O ' HG23 ' A' ' 109' ' ' VAL . 74.0 mmtt -76.49 -37.05 57.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.178 -0.919 . . . . 2.4399999999999999 109.064 178.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 35.4 tp -59.58 -37.58 78.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.549 -0.75 . . . . 1.27 109.974 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.556 ' O ' ' HB2' ' A' ' 111' ' ' ASN . 36.7 m -61.04 -37.48 82.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.619 -0.719 . . . . 1.1499999999999999 110.328 179.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.9 mtt180 -70.24 -38.19 75.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 3.6000000000000001 110.555 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.443 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 61.8 t -60.9 -57.2 13.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.039 -0.528 . . . . 1.25 110.719 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.445 ' HA ' HD12 ' A' ' 113' ' ' LEU . 10.8 p -65.18 -28.97 45.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.182 -0.463 . . . . 1.1100000000000001 111.054 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.556 ' HB2' ' O ' ' A' ' 107' ' ' SER . 56.0 t30 -60.33 -55.71 30.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.248 -0.433 . . . . 1.74 110.307 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 95.7 mt -62.95 -36.19 74.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.092 -0.504 . . . . 1.21 111.154 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.445 HD12 ' HA ' ' A' ' 110' ' ' VAL . 71.5 mt -56.36 -42.8 78.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.363 -0.38 . . . . 1.3300000000000001 111.764 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.78 -29.32 19.86 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.816 -0.353 . . . . 1.6899999999999999 111.372 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -65.57 -38.55 89.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.764 0.316 . . . . 2.2000000000000002 111.561 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 7.9 mmm180 -96.11 5.61 50.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.347 -0.388 . . . . 3.23 111.012 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.0 m120 52.22 57.75 6.13 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.391 0.615 . . . . 2.0 110.901 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 43.2 mm -76.13 -33.63 24.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.552 -0.749 . . . . 0.60999999999999999 110.286 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' PHE . . . . . 0.432 ' HE2' HD13 ' A' ' 113' ' ' LEU . 80.5 m-85 -110.47 171.91 7.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.776 -0.647 . . . . 1.26 110.811 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.0 t -69.65 146.98 51.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.744 -0.662 . . . . 1.3 109.932 179.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 50.7 pttt -59.47 -27.48 66.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.759 0.281 . . . . 2.8500000000000001 111.759 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -68.78 -44.23 74.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.842 0.353 . . . . 2.9500000000000002 110.817 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.54 ' O ' HG13 ' A' ' 127' ' ' ILE . 9.1 p -82.47 -28.42 8.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.416 -0.356 . . . . 1.28 110.912 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 7.3 t -61.26 -43.22 96.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 109.633 -0.506 . . . . 1.23 109.633 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -64.7 -35.43 81.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.674 -0.694 . . . . 1.74 109.963 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -63.57 -41.26 98.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.872 -0.604 . . . . 1.4399999999999999 110.219 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.54 HG13 ' O ' ' A' ' 123' ' ' VAL . 63.6 mt -62.73 -53.99 39.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.799 -0.637 . . . . 0.46999999999999997 111.334 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -63.55 -36.54 84.12 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 120.994 -0.282 . . . . 2.0499999999999998 111.08 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -61.98 -39.74 93.22 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.847 -0.427 . . . . 3.98 109.847 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 44.6 m -67.53 -39.77 85.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.916 -0.583 . . . . 0.69999999999999996 110.493 179.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.0 mt -69.16 -29.45 67.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.094 -0.503 . . . . 1.3300000000000001 110.927 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -78.78 -37.79 40.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.197 -0.456 . . . . 0.68999999999999995 110.503 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.02 -19.26 62.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.829 -0.623 . . . . 0.83999999999999997 111.782 -179.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.436 ' HB1' ' HG3' ' A' ' 136' ' ' GLU . . . -61.13 -44.87 96.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.432 -0.349 . . . . 1.1200000000000001 111.072 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 68.9 mt 55.47 45.21 25.62 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.989 -0.55 . . . . 4.04 112.078 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.436 ' HG3' ' HB1' ' A' ' 134' ' ' ALA . 0.0 OUTLIER -106.21 3.19 27.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.045 0.45 . . . . 6.6399999999999997 110.687 179.46 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.53 -0.747 . . . . 8.0 110.589 -179.605 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 206' ' ' PRO . . . . . 0.521 ' CB ' ' HA ' ' A' ' 18' ' ' SER . 2.8 Cg_exo . . . . . 0 CA--C 1.53 0.323 0 N-CA-C 111.634 -0.179 . . . . 7.4699999999999998 111.634 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 3.2 m 59.64 81.1 0.18 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.189 0.519 . . . . 6.0199999999999996 111.242 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . 0.47 ' HA ' ' OE1' ' A' ' 19' ' ' GLN . 3.4 t80 -65.27 113.4 4.0 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.973 -0.454 . . . . 4.0700000000000003 110.471 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 209' ' ' SEP . . . . . 0.413 ' O3P' ' HD2' ' B' ' 210' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . 0.413 ' HD2' ' O3P' ' B' ' 209' ' ' SEP . 51.9 Cg_exo -54.59 -30.4 65.25 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.791 2.327 . . . . 4.3499999999999996 112.757 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.17 -7.12 58.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.026 0.441 . . . . 4.9500000000000002 110.977 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 9.0 m -139.5 72.55 37.01 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.523 -0.308 . . . . 3.1600000000000001 110.522 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 213' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -76.21 -59.67 0.04 OUTLIER 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.887 2.392 . . . . 4.0300000000000002 111.985 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.191 0 CA-C-O 118.56 -0.733 . . . . 5.5700000000000003 110.136 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.963 0 CA-C-O 120.804 0.335 . . . . 5.4699999999999998 110.724 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -102.78 162.56 12.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.351 -0.386 . . . . 5.3399999999999999 110.428 179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -75.92 94.51 3.38 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.178 -0.465 . . . . 2.73 111.483 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -81.79 148.07 29.07 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.157 -0.474 . . . . 3.2400000000000002 110.471 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.448 ' HG3' ' HB ' ' A' ' 9' ' ' THR . 0.0 OUTLIER 60.9 37.72 18.22 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 123.373 0.421 . . . . 2.8999999999999999 111.693 179.186 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -56.46 -61.12 2.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.283 -0.417 . . . . 2.75 111.724 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -68.54 -42.56 78.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.05 0.452 . . . . 0.91000000000000003 111.206 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.448 ' HB ' ' HG3' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -59.92 -42.49 94.04 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.964 0.727 . . . . 0.85999999999999999 112.964 -178.57 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 6' ' ' GLU . 0.5 OUTLIER -72.11 -21.92 61.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.61 0.243 . . . . 1.4199999999999999 111.385 -179.131 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -69.49 -36.74 76.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.74 0.305 . . . . 1.3 110.42 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -64.97 -28.88 69.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.236 0.541 . . . . 1.5700000000000001 110.708 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -78.9 -10.59 59.86 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.673 -0.694 . . . . 1.5900000000000001 110.919 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.59 36.28 4.64 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.171 0.51 . . . . 1.6299999999999999 111.155 -179.529 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 15' ' ' LEU . 13.9 mt -112.36 163.2 14.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.051 0.453 . . . . 1.1000000000000001 111.286 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -134.06 160.77 36.76 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.571 -0.74 . . . . 2.1600000000000001 109.133 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -79.82 29.31 0.26 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.777 0.323 . . . . 1.9399999999999999 111.701 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.585 ' OG ' ' HB3' ' B' ' 206' ' ' PRO . 68.6 m -93.32 140.95 28.99 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.179 -0.304 . . . . 1.6100000000000001 110.179 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.641 ' OE1' ' HA ' ' B' ' 208' ' ' TYR . 0.4 OUTLIER -56.49 -52.86 63.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.121 -0.491 . . . . 2.6400000000000001 110.333 -179.342 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -61.48 -40.77 95.76 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.908 -0.587 . . . . 2.9900000000000002 111.775 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.535 ' OG ' ' HB2' ' A' ' 18' ' ' SER . 18.1 m -59.25 -49.1 79.13 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.765 0.316 . . . . 1.1000000000000001 110.968 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.1 mm -64.1 -41.91 93.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.726 -0.472 . . . . 0.88 109.726 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.6 m -59.04 -40.88 86.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.928 -0.578 . . . . 1.1799999999999999 111.01 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.3 m -61.26 -47.16 87.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 1.1599999999999999 110.825 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.38 -42.0 79.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.347 -0.388 . . . . 0.45000000000000001 111.052 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 19.1 m -62.7 -36.64 83.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.28 -0.418 . . . . 1.3200000000000001 111.244 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.9 ttpt -61.24 -40.91 95.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.811 0.339 . . . . 2.3799999999999999 110.532 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 33.1 t90 -68.59 -38.24 80.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.955 0.407 . . . . 0.97999999999999998 109.916 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -64.12 -41.06 97.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.796 -0.638 . . . . 1.3 110.756 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.66 -33.24 73.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.119 -0.491 . . . . 1.0600000000000001 110.732 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 74.8 mt -73.04 -25.18 60.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.968 -0.56 . . . . 1.71 110.308 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 70.9 mm-40 -97.93 48.42 1.01 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.044 -0.525 . . . . 1.51 110.613 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.452 ' HA ' ' CZ ' ' A' ' 79' ' ' PHE . 6.6 p90 -59.71 -21.31 60.44 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.681 -0.69 . . . . 1.6100000000000001 111.614 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -75.64 -14.77 60.38 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.28 -0.418 . . . . 3.9700000000000002 111.363 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -109.44 12.72 24.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.778 0.323 . . . . 1.7 110.899 -179.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.463 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -51.45 -51.02 73.17 Favored Pre-proline 0 CA--C 1.538 0.483 0 CA-C-N 115.903 -0.59 . . . . 0.42999999999999999 112.414 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 39.3 Cg_endo -66.07 -19.92 57.19 Favored 'Trans proline' 0 C--N 1.357 0.978 0 C-N-CA 121.888 1.725 . . . . 0.5 112.831 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.7 tptm -88.28 -46.26 9.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.672 0.272 . . . . 2.7799999999999998 110.821 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.2 m -67.44 -28.36 41.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.964 -0.294 . . . . 0.39000000000000001 110.854 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.98 -46.77 80.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.362 -0.381 . . . . 0.32000000000000001 111.337 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -70.41 -38.09 74.56 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.891 -0.324 . . . . 1.3999999999999999 110.454 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 68.8 mtm -63.12 -41.91 99.42 Favored 'General case' 0 CA--C 1.521 -0.168 0 N-CA-C 109.98 -0.378 . . . . 1.51 109.98 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 71.1 t90 -61.95 -48.57 79.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.616 -0.72 . . . . 0.40999999999999998 110.256 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.509 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 16.1 ttpt -58.71 -49.51 77.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.807 -0.633 . . . . 1.1100000000000001 110.65 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.486 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 57.7 mm-40 -60.85 -42.3 97.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.886 -0.597 . . . . 1.96 111.087 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 76.3 t80 -62.65 -47.7 82.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.104 -0.498 . . . . 1.5800000000000001 111.109 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 74.6 mmm -64.55 -20.8 66.45 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.26 -0.427 . . . . 0.69999999999999996 111.988 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 44' ' ' LYS . 64.0 mt -97.63 0.12 46.67 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.626 0.232 . . . . 0.88 111.626 -179.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.486 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 27.0 mtp180 -79.03 135.64 58.42 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.628 0.251 . . . . 2.6899999999999999 110.528 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.12 5.95 3.28 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.909 2.406 . . . . 0.93999999999999995 112.81 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.1 m -103.22 8.23 38.46 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.097 -0.501 . . . . 1.3300000000000001 110.347 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.5 t -111.54 123.6 67.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.984 -0.553 . . . . 0.58999999999999997 111.065 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -73.3 153.7 40.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.0 -0.545 . . . . 1.8 110.641 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.09 -32.56 62.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 0.81000000000000005 112.193 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -42.37 98.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.875 0.369 . . . . 3.5800000000000001 110.79 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.9 mtm-85 -71.57 -29.8 65.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.246 -0.434 . . . . 3.0499999999999998 110.617 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 54.2 mttt -65.28 -34.43 78.33 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.334 -0.617 . . . . 0.58999999999999997 109.334 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 21.4 tp -67.53 -41.25 84.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.803 -0.635 . . . . 1.26 109.315 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.7 mp -63.75 -44.83 92.32 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.291 -0.868 . . . . 1.54 110.032 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.16 -35.39 91.46 Favored Glycine 0 C--N 1.333 0.383 0 CA-C-N 115.845 -0.616 . . . . 0.37 111.949 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.36 -44.31 91.82 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.666 -0.494 . . . . 1.23 109.666 179.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -65.81 -34.47 78.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.801 -0.636 . . . . 1.3799999999999999 111.114 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 39.3 tp -63.84 -44.14 94.07 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.76 -0.459 . . . . 1.45 109.76 178.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.449 ' O ' HG22 ' A' ' 68' ' ' VAL . 15.8 tmm? -64.97 -44.32 89.77 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.688 -0.687 . . . . 0.60999999999999999 109.897 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -57.67 -39.7 77.68 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.817 -0.628 . . . . 1.6899999999999999 110.999 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -67.04 -52.73 38.62 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.081 -0.509 . . . . 1.54 111.44 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 31.5 m -63.18 -34.89 69.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 112.817 0.673 . . . . 1.3999999999999999 112.817 -178.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.449 HG22 ' O ' ' A' ' 64' ' ' MET . 34.6 m -78.5 -24.77 13.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 C-N-CA 120.276 -0.57 . . . . 0.42999999999999999 110.969 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -76.74 -45.81 27.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.155 0.502 . . . . 2.02 109.953 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -75.29 -16.36 60.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.617 -0.719 . . . . 2.1000000000000001 110.819 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.47 -33.99 73.38 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 116.06 -0.518 . . . . 0.51000000000000001 110.682 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.555 ' HG2' HE22 ' A' ' 80' ' ' GLN . 1.8 mmtp -68.35 -27.32 66.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 2.0899999999999999 110.347 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.01 -46.37 73.77 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.932 -0.576 . . . . 0.66000000000000003 111.801 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -87.38 -6.56 58.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.981 0.42 . . . . 1.6200000000000001 110.352 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.88 27.17 9.09 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.25 -0.886 . . . . 2.7000000000000002 111.668 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.7 mm -94.44 87.71 2.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 109.343 -0.614 . . . . 0.63 109.343 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 18.2 pt -72.33 -8.8 12.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.901 -0.59 . . . . 0.85999999999999999 111.796 -178.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -60.16 -33.38 72.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.918 0.389 . . . . 2.2200000000000002 110.388 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.452 ' CZ ' ' HA ' ' A' ' 33' ' ' TYR . 29.7 m-85 -69.04 -48.72 62.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.873 -0.603 . . . . 1.3400000000000001 109.615 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.555 HE22 ' HG2' ' A' ' 72' ' ' LYS . 86.0 mt-30 -65.19 -32.13 73.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.301 -0.863 . . . . 1.3 111.553 -179.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.501 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 9.5 t70 -72.74 -53.64 11.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.834 0.349 . . . . 1.3200000000000001 110.406 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.4 m -63.65 -42.58 98.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.062 -0.517 . . . . 0.93999999999999995 111.774 -179.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -78.35 -29.19 47.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.616 -0.265 . . . . 1.23 110.977 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -64.95 -41.65 97.26 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 121.049 -0.596 . . . . 0.34000000000000002 113.346 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.501 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 12.8 ptpt -68.82 -18.34 64.15 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.042 0.386 . . . . 1.3100000000000001 112.042 -178.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 32.6 m -107.95 -19.91 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 121.008 -0.277 . . . . 0.38 111.222 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.13 95.6 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.431 -0.35 . . . . 0.38 110.96 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.73 -44.2 73.33 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.077 -0.511 . . . . 0.45000000000000001 110.624 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.411 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 35.4 tp10 -63.68 -58.72 6.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.601 -0.727 . . . . 1.5600000000000001 110.208 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.485 ' O ' HG12 ' A' ' 94' ' ' ILE . 80.7 t -54.03 -50.27 55.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.761 -0.654 . . . . 0.34000000000000002 111.994 -179.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 81.7 mt -60.97 -42.5 98.42 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.641 0.237 . . . . 1.45 111.641 -179.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -67.86 -25.02 74.33 Favored Glycine 0 CA--C 1.519 0.318 0 C-N-CA 120.718 -0.753 . . . . 0.40999999999999998 112.241 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.411 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 33.5 mmm-85 -83.31 -55.05 4.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.641 0.258 . . . . 3.46 111.213 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.485 HG12 ' O ' ' A' ' 90' ' ' VAL . 30.6 pt -66.38 -19.8 26.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 112.359 0.503 . . . . 0.5 112.359 -178.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.1 t30 -63.45 -24.27 67.76 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.256 0.551 . . . . 1.0 110.31 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -90.74 -14.1 32.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.058 -0.519 . . . . 1.1399999999999999 110.73 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -101.91 -28.69 12.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.03 -0.532 . . . . 1.3300000000000001 111.048 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -70.26 121.76 84.21 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.166 -0.47 . . . . 1.3899999999999999 111.411 -179.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -68.64 175.91 6.54 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.417 2.078 . . . . 1.47 111.822 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 13.5 ptt-85 -53.02 -27.67 20.53 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.052 -0.522 . . . . 4.8700000000000001 112.106 -179.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -76.37 -48.42 19.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.028 0.442 . . . . 2.5800000000000001 111.776 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 22.3 mt -76.7 -35.36 57.93 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.737 0.643 . . . . 0.84999999999999998 112.737 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 6.0 pttp -64.89 -25.22 67.8 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.733 -0.387 . . . . 2.3599999999999999 110.993 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' A' ' 100' ' ' ARG . 47.6 mtmt -66.31 -37.74 86.08 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.221 -0.659 . . . . 2.5699999999999998 109.221 178.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -75.68 -34.26 60.42 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.162 -0.926 . . . . 2.4399999999999999 109.798 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 7.0 tt -63.79 -41.99 97.82 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.417 -0.81 . . . . 1.27 109.985 178.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 21.0 m -62.58 -32.5 73.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.126 -0.488 . . . . 1.1499999999999999 110.611 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 70.6 mtt180 -67.17 -55.43 14.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.028 -0.533 . . . . 3.6000000000000001 111.286 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 7.7 p -62.48 -42.5 95.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.307 -0.406 . . . . 1.25 111.983 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.72 -40.56 82.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 120.836 0.35 . . . . 1.1100000000000001 110.555 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.458 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 11.9 t-20 -61.28 -48.56 80.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.867 -0.606 . . . . 1.74 110.637 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 63.3 mt -61.12 -46.71 96.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.281 -0.418 . . . . 1.21 111.347 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 96.3 mt -59.12 -42.49 90.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.094 -0.503 . . . . 1.3300000000000001 112.291 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 111' ' ' ASN . 1.2 ptpt -78.48 -33.31 48.31 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.054 0.39 . . . . 1.6899999999999999 112.054 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -75.62 -39.2 58.19 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.906 0.336 . . . . 2.2000000000000002 111.906 -178.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -79.96 -1.15 38.24 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.033 0.444 . . . . 3.23 110.801 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 60.8 50.76 5.18 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.589 -0.732 . . . . 2.0 111.454 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 45.9 mm -72.47 -40.6 63.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.091 0.472 . . . . 0.60999999999999999 110.235 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -109.52 173.85 6.13 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.938 -0.574 . . . . 1.26 109.835 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.78 162.69 29.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.175 -0.466 . . . . 1.3 110.863 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 15.2 mmmt -52.74 -50.27 63.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.17 -0.468 . . . . 2.8500000000000001 111.292 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -56.37 -34.45 66.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.843 -0.617 . . . . 2.9500000000000002 112.072 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 61.6 t -80.14 -49.58 18.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.793 0.294 . . . . 1.28 111.793 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 34.7 m -62.63 -29.74 47.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 C-N-CA 120.964 -0.294 . . . . 1.23 111.159 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -78.92 -27.16 43.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.931 0.395 . . . . 1.74 110.819 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.48 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 44.8 t0 -76.63 -41.25 46.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.267 0.556 . . . . 1.4399999999999999 109.959 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 96.3 mt -60.08 -50.97 78.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.826 -0.624 . . . . 0.46999999999999997 111.42 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -65.65 -37.39 86.41 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.123 0.416 . . . . 2.0499999999999998 112.123 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.48 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 33.2 ptt180 -69.63 -26.03 64.22 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 120.761 -0.376 . . . . 3.98 110.785 -179.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 49.3 m -68.36 -39.18 81.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.294 0.568 . . . . 0.69999999999999996 109.684 178.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.8 mp -67.39 -41.93 84.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.735 -0.666 . . . . 1.3300000000000001 110.123 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.06 -34.9 77.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.795 -0.638 . . . . 0.68999999999999995 111.043 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -73.14 -25.08 60.69 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.825 0.345 . . . . 0.83999999999999997 111.086 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -78.32 -23.44 47.04 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.513 -0.312 . . . . 1.1200000000000001 110.992 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 54.3 mt 58.07 31.8 21.16 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.778 -0.646 . . . . 4.04 111.124 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -95.49 7.05 47.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.339 0.59 . . . . 6.6399999999999997 110.682 -179.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.587 -0.721 . . . . 8.0 110.065 -179.773 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 206' ' ' PRO . . . . . 0.585 ' HB3' ' OG ' ' A' ' 18' ' ' SER . 3.8 Cg_exo . . . . . 0 N--CA 1.476 0.488 0 N-CA-C 111.201 -0.346 . . . . 7.4699999999999998 111.201 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 18.4 m 59.5 83.26 0.13 Allowed 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.489 0.661 . . . . 6.0199999999999996 111.78 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . 0.641 ' HA ' ' OE1' ' A' ' 19' ' ' GLN . 7.4 t80 -71.89 133.08 45.21 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.681 -0.69 . . . . 4.0700000000000003 110.196 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 209' ' ' SEP . . . . . 0.507 ' HB2' ' OG ' ' B' ' 212' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -55.91 -32.89 87.12 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.988 2.459 . . . . 4.3499999999999996 114.012 -178.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -88.15 0.36 56.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.921 0.391 . . . . 4.9500000000000002 111.35 -179.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 212' ' ' SER . . . . . 0.507 ' OG ' ' HB2' ' B' ' 209' ' ' SEP . 0.1 OUTLIER -140.29 79.89 20.5 Favored Pre-proline 0 C--O 1.235 0.34 0 CA-C-N 116.39 -0.368 . . . . 3.1600000000000001 110.252 179.292 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 213' ' ' PRO . . . . . 0.453 ' HA ' ' CZ ' ' B' ' 208' ' ' TYR . 73.3 Cg_endo -75.49 -30.7 6.24 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.836 2.357 . . . . 4.0300000000000002 112.955 -179.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 8.9 m . . . . . 0 C--O 1.248 0.991 0 CA-C-O 117.781 -1.104 . . . . 5.5700000000000003 109.041 -179.789 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 120.719 0.295 . . . . 5.4699999999999998 110.681 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -121.29 151.16 40.37 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.864 -0.421 . . . . 5.3399999999999999 109.864 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.0 m -64.53 111.41 2.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.037 0.446 . . . . 2.73 110.602 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 m -88.28 135.78 33.29 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.912 -0.586 . . . . 3.2400000000000002 111.536 -179.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 53.07 58.36 5.39 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.39 -0.823 . . . . 2.8999999999999999 112.248 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.587 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 48.8 mt-30 -65.76 -34.73 78.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.746 -0.661 . . . . 2.75 110.08 179.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.574 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 70.3 t80 -59.11 -48.97 79.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.73 -0.668 . . . . 0.91000000000000003 110.508 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.0 -39.08 88.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.889 -0.596 . . . . 0.85999999999999999 111.039 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -64.99 -32.49 74.24 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 115.889 -0.596 . . . . 1.4199999999999999 111.197 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 27.6 mmmt -76.49 -40.72 49.45 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 121.065 -0.254 . . . . 1.3 110.589 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.15 -39.78 91.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.067 -0.515 . . . . 1.5700000000000001 111.381 -179.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -76.11 -1.96 28.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.425 -0.352 . . . . 1.5900000000000001 111.599 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.7 m -126.93 32.39 5.12 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.586 0.708 . . . . 1.6299999999999999 110.155 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 15' ' ' LEU . 14.6 mt -111.75 168.1 9.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.683 -0.69 . . . . 1.1000000000000001 111.162 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.541 ' HG2' ' H ' ' A' ' 17' ' ' ASP . 11.1 tt0 -137.9 173.72 11.33 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.551 -0.907 . . . . 2.1600000000000001 108.551 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.541 ' H ' ' HG2' ' A' ' 16' ' ' GLU . 4.6 p30 -79.78 16.43 1.14 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.768 0.318 . . . . 1.9399999999999999 111.665 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.413 ' O ' HG12 ' A' ' 22' ' ' ILE . 0.0 OUTLIER -82.07 132.67 35.25 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.832 -0.433 . . . . 1.6100000000000001 109.832 178.885 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.45 ' HG2' ' N ' ' A' ' 20' ' ' GLU . 16.5 pm0 -62.94 -39.21 93.93 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.019 0.377 . . . . 2.6400000000000001 112.019 -178.33 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.45 ' N ' ' HG2' ' A' ' 19' ' ' GLN . 5.9 tp10 -71.31 -25.62 62.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.995 0.426 . . . . 2.9900000000000002 110.152 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 66.8 m -71.21 -44.32 65.63 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.9 -0.778 . . . . 1.1000000000000001 108.9 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 18' ' ' SER . 47.2 mm -65.29 -45.09 94.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 108.69 -0.856 . . . . 0.88 108.69 178.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.8 t -54.86 -43.81 73.42 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.208 -0.905 . . . . 1.1799999999999999 110.884 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.8 t -58.45 -43.51 88.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 1.1599999999999999 110.857 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.9 -45.15 59.78 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.266 -0.424 . . . . 0.45000000000000001 110.989 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 34.4 m -59.8 -40.65 89.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.325 -0.398 . . . . 1.3200000000000001 111.306 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.57 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 8.2 mptt -56.97 -43.97 82.15 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.085 0.469 . . . . 2.3799999999999999 110.273 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 24.2 t90 -68.93 -36.68 78.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.674 -0.694 . . . . 0.97999999999999998 110.454 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -66.85 -43.64 83.1 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.193 -0.458 . . . . 1.3 110.91 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.4 mt -60.3 -27.41 67.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.071 -0.513 . . . . 1.0600000000000001 111.793 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 77.8 mt -68.37 -39.09 81.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.934 0.397 . . . . 1.71 111.109 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.423 ' H ' ' HG2' ' A' ' 32' ' ' GLN . 9.5 pt20 -95.28 56.77 1.92 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.454 0.645 . . . . 1.51 110.716 -179.617 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.408 ' HA ' ' CE2' ' A' ' 79' ' ' PHE . 36.5 p90 -64.51 -17.24 63.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.476 -0.784 . . . . 1.6100000000000001 111.557 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 34' ' ' ARG . 9.3 ttp180 -79.9 -3.7 49.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.831 0.348 . . . . 3.9700000000000002 111.229 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.45 22.18 12.23 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.073 0.463 . . . . 1.7 110.05 179.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.459 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -52.05 -51.75 68.39 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.253 -0.885 . . . . 0.42999999999999999 112.274 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.46 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 24.1 Cg_endo -62.77 -33.06 77.58 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 121.721 1.614 . . . . 0.5 112.521 179.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -46.73 72.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.334 -0.394 . . . . 2.7799999999999998 111.059 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.2 m -74.56 -25.72 19.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.684 -0.406 . . . . 0.39000000000000001 110.728 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.05 -49.99 65.74 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.359 -0.382 . . . . 0.32000000000000001 110.769 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 37' ' ' PRO . 4.1 pt-20 -66.71 -35.94 81.31 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.328 -0.396 . . . . 1.3999999999999999 110.258 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.574 ' SD ' ' HB3' ' A' ' 8' ' ' PHE . 16.3 ttm -65.18 -40.67 94.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.095 -0.502 . . . . 1.51 109.946 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 67.4 t90 -63.78 -48.03 78.53 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.793 -0.64 . . . . 0.40999999999999998 109.645 178.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.8 ttpt -59.75 -46.89 87.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.785 -0.643 . . . . 1.1100000000000001 110.396 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.548 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 0.8 OUTLIER -59.72 -47.14 86.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.989 -0.55 . . . . 1.96 110.526 179.798 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -61.37 -49.64 76.11 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.714 -0.675 . . . . 1.5800000000000001 111.549 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 89.0 mmm -63.4 -28.38 69.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.376 -0.374 . . . . 0.69999999999999996 111.937 -179.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 73.6 mt -97.89 22.48 9.2 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 111.648 0.24 . . . . 0.88 111.648 -179.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 11.2 mtp180 -101.18 139.22 20.28 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.722 0.296 . . . . 2.6899999999999999 110.689 179.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.26 -1.81 11.47 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 123.128 2.552 . . . . 0.93999999999999995 112.789 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.15 17.34 21.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.998 -0.546 . . . . 1.3300000000000001 110.751 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 24.2 t -123.32 114.8 43.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.082 -0.508 . . . . 0.58999999999999997 111.15 -179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -67.23 159.65 28.66 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.93 -0.577 . . . . 1.8 110.02 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.35 -37.9 73.3 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.54 0.57 . . . . 0.81000000000000005 112.54 -178.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -40.94 95.53 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.604 0.24 . . . . 3.5800000000000001 110.613 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.1 mtm-85 -70.56 -36.46 73.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.407 -0.36 . . . . 3.0499999999999998 110.465 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -65.37 -37.37 86.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.419 0.628 . . . . 0.58999999999999997 109.369 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 19.2 tp -64.08 -36.81 85.23 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.585 -0.734 . . . . 1.26 109.595 178.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.3 mp -68.21 -39.37 82.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.41 -0.814 . . . . 1.54 109.819 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.29 -32.95 85.9 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 111.452 -0.659 . . . . 0.37 111.452 179.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.431 HD21 HD21 ' A' ' 91' ' ' LEU . 0.4 OUTLIER -67.24 -40.19 86.29 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.431 -0.581 . . . . 1.23 109.431 178.643 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -60.35 -44.57 95.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.555 -0.748 . . . . 1.3799999999999999 110.264 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 12.4 tp -63.25 -43.9 96.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.004 -0.544 . . . . 1.45 110.701 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.439 ' O ' HG22 ' A' ' 68' ' ' VAL . 12.7 tmm? -59.86 -49.62 76.98 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.006 -0.543 . . . . 0.60999999999999999 110.392 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -59.25 -42.69 91.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.062 0.458 . . . . 1.6899999999999999 110.325 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 40.5 t-80 -61.99 -53.82 50.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.708 -0.678 . . . . 1.54 112.1 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 35.8 m -62.05 -37.45 78.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 N-CA-C 112.89 0.7 . . . . 1.3999999999999999 112.89 -177.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.439 HG22 ' O ' ' A' ' 64' ' ' MET . 33.0 m -79.06 -27.04 13.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 120.368 -0.533 . . . . 0.42999999999999999 111.44 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -72.12 -49.06 39.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.995 0.426 . . . . 2.02 109.854 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -71.44 -20.21 62.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.805 -0.634 . . . . 2.1000000000000001 110.614 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.1 -21.54 66.57 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.052 -0.522 . . . . 0.51000000000000001 111.201 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.416 ' HD3' HE22 ' A' ' 80' ' ' GLN . 1.0 OUTLIER -69.87 -31.47 69.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.775 0.322 . . . . 2.0899999999999999 110.298 179.43 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -75.89 -40.78 29.8 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.632 -0.794 . . . . 0.66000000000000003 111.232 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -79.52 -12.63 59.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.71 -0.245 . . . . 1.6200000000000001 110.555 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 41.1 mttp 65.27 34.07 8.67 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 123.658 0.599 . . . . 2.7000000000000002 110.93 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 27.0 mm -93.06 85.55 2.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.043 -0.526 . . . . 0.63 110.264 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 19.5 pt -69.95 -24.89 26.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.761 -0.654 . . . . 0.85999999999999999 110.999 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.83 -35.47 74.81 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.104 -0.498 . . . . 2.2200000000000002 110.713 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.408 ' CE2' ' HA ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -69.75 -49.13 56.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.249 -0.432 . . . . 1.3400000000000001 110.333 179.633 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.416 HE22 ' HD3' ' A' ' 72' ' ' LYS . 94.9 mt-30 -63.31 -35.64 81.04 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.482 -0.781 . . . . 1.3 111.027 -179.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.547 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 17.3 t70 -66.53 -51.11 60.19 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.081 0.467 . . . . 1.3200000000000001 110.544 179.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.8 m -63.24 -42.28 99.2 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.447 -0.797 . . . . 0.93999999999999995 111.84 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -77.87 -35.09 51.32 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.965 -0.294 . . . . 1.23 111.334 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.84 -40.89 98.87 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 121.393 -0.432 . . . . 0.34000000000000002 113.845 -178.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.547 ' HE3' ' O ' ' A' ' 81' ' ' ASP . 14.3 ptpt -65.98 -24.27 66.75 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 117.148 0.474 . . . . 1.3100000000000001 112.234 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.2 m -105.1 -15.13 8.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 C-N-CA 120.914 -0.314 . . . . 0.38 111.022 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.73 -49.99 74.21 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.193 -0.458 . . . . 0.38 111.215 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.1 -41.61 75.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.496 . . . . 0.45000000000000001 111.04 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.555 ' O ' ' HG2' ' A' ' 93' ' ' ARG . 4.8 tp10 -62.62 -60.07 4.03 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.753 -0.658 . . . . 1.5600000000000001 110.449 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.512 ' O ' HG12 ' A' ' 94' ' ' ILE . 72.6 t -56.45 -49.22 78.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.728 -0.669 . . . . 0.34000000000000002 111.835 -178.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.431 HD21 HD21 ' A' ' 61' ' ' LEU . 54.4 mt -58.63 -38.32 77.82 Favored 'General case' 0 C--N 1.331 -0.22 0 O-C-N 123.146 0.279 . . . . 1.45 111.532 -179.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -70.6 -28.89 70.3 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.703 -0.761 . . . . 0.40999999999999998 112.72 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.555 ' HG2' ' O ' ' A' ' 89' ' ' GLU . 23.9 mmm-85 -83.44 -49.62 9.12 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 122.857 -0.202 . . . . 3.46 111.3 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.512 HG12 ' O ' ' A' ' 90' ' ' VAL . 20.8 pt -66.09 -20.37 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 N-CA-C 111.988 0.366 . . . . 0.5 111.988 -178.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.42 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 51.8 t30 -63.1 -28.16 69.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.333 0.587 . . . . 1.0 109.937 179.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -88.67 -13.21 40.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.724 -0.671 . . . . 1.1399999999999999 110.738 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -97.1 -38.03 9.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.968 -0.56 . . . . 1.3300000000000001 111.147 -179.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 14.0 m-30 -72.8 125.94 90.9 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 116.424 -0.353 . . . . 1.3899999999999999 110.932 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.48 177.44 3.96 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.554 2.169 . . . . 1.47 112.029 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 13.8 ptt-85 -52.61 -36.05 55.57 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 112.862 0.69 . . . . 4.8700000000000001 112.862 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.481 ' HA ' ' HE2' ' A' ' 104' ' ' LYS . 1.3 m-20 -76.66 -25.28 53.55 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.741 0.645 . . . . 2.5800000000000001 112.741 -178.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 14.9 mt -93.37 -31.18 14.75 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.868 -0.333 . . . . 0.84999999999999998 110.972 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . 0.523 ' HA ' HD23 ' A' ' 106' ' ' LEU . 32.0 pttt -63.14 -31.61 72.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.456 -0.338 . . . . 2.3599999999999999 111.134 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.481 ' HE2' ' HA ' ' A' ' 101' ' ' ASP . 51.3 mtmt -64.43 -37.92 89.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.053 0.454 . . . . 2.5699999999999998 110.302 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.6 mttm -70.46 -40.97 73.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.843 -0.617 . . . . 2.4399999999999999 109.852 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.523 HD23 ' HA ' ' A' ' 103' ' ' LYS . 0.1 OUTLIER -65.31 -35.91 82.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.955 -0.566 . . . . 1.27 109.728 178.877 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 65.1 m -62.89 -37.18 85.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.185 -0.461 . . . . 1.1499999999999999 110.362 178.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 39.1 mtt180 -65.05 -36.52 84.6 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 109.847 -0.427 . . . . 3.6000000000000001 109.847 179.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 49.1 t -67.37 -49.76 68.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.991 -0.55 . . . . 1.25 110.013 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 71.0 t -59.16 -37.1 66.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.208 0.527 . . . . 1.1100000000000001 110.043 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -60.12 -59.61 5.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.342 -0.844 . . . . 1.74 111.06 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.7 tt -61.41 -34.31 60.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 N-CA-C 111.847 0.314 . . . . 1.21 111.847 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 73.6 mt -63.09 -49.98 72.32 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.931 0.345 . . . . 1.3300000000000001 111.931 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.6 ptpt -82.56 -29.1 30.54 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.07 0.396 . . . . 1.6899999999999999 112.07 -178.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -67.18 -41.9 85.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.715 0.293 . . . . 2.2000000000000002 110.908 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -90.8 3.69 53.72 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.529 -0.305 . . . . 3.23 110.523 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 51.27 59.28 4.71 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.618 -0.719 . . . . 2.0 111.059 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 46.6 mm -73.89 -38.75 50.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.677 -0.692 . . . . 0.60999999999999999 109.888 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -107.15 169.52 8.51 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.691 -0.686 . . . . 1.26 109.569 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.52 157.67 19.83 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 123.27 0.356 . . . . 1.3 110.517 179.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.405 ' HA ' HG22 ' A' ' 124' ' ' VAL . 0.0 OUTLIER -57.25 -35.39 69.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.506 -0.315 . . . . 2.8500000000000001 111.429 -178.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -68.11 -37.01 80.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.826 0.346 . . . . 2.9500000000000002 110.764 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 58.5 t -70.46 -47.11 67.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.326 -0.397 . . . . 1.28 110.88 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.405 HG22 ' HA ' ' A' ' 121' ' ' LYS . 27.5 m -66.21 -24.31 33.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.982 0.42 . . . . 1.23 110.43 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.27 -20.57 47.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.879 -0.601 . . . . 1.74 110.241 179.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.504 ' O ' ' HG2' ' A' ' 129' ' ' ARG . 20.3 t0 -83.87 -39.57 19.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.421 0.629 . . . . 1.4399999999999999 109.721 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 63.1 mt -61.93 -46.5 96.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.701 -0.681 . . . . 0.46999999999999997 110.91 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -66.36 -37.85 86.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.431 -0.35 . . . . 2.0499999999999998 111.764 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' A' ' 126' ' ' ASP . 30.5 ptt180 -68.93 -39.57 79.53 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.84 -0.344 . . . . 3.98 110.741 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 48.7 m -70.24 -35.37 73.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.948 0.404 . . . . 0.69999999999999996 110.794 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.9 -45.6 81.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.181 -0.463 . . . . 1.3300000000000001 110.266 179.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.83 -39.15 69.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.726 -0.67 . . . . 0.68999999999999995 111.535 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.27 -31.68 72.3 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.82 0.343 . . . . 0.83999999999999997 111.498 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.6 -19.56 65.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.098 -0.501 . . . . 1.1200000000000001 111.589 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 95.3 mt 58.0 32.06 21.47 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.282 0.563 . . . . 4.04 111.095 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 95' ' ' ASN . 8.3 tp10 -99.29 1.21 44.4 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.954 -0.566 . . . . 6.6399999999999997 110.75 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 . . . . . 0 C--O 1.244 0.771 0 CA-C-O 118.623 -0.704 . . . . 8.0 109.341 -179.986 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 206' ' ' PRO . . . . . 0.407 ' HB2' ' HA ' ' A' ' 18' ' ' SER . 18.7 Cg_exo . . . . . 0 N--CA 1.473 0.288 0 N-CA-C 111.657 -0.17 . . . . 7.4699999999999998 111.657 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 50.1 m 70.0 74.58 0.22 Allowed 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 121.54 0.686 . . . . 6.0199999999999996 112.575 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -65.37 133.06 50.56 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.861 -0.609 . . . . 4.0700000000000003 110.507 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 209' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -52.25 -30.99 44.33 Favored 'Trans proline' 0 N--CA 1.476 0.443 0 C-N-CA 122.8 2.333 . . . . 4.3499999999999996 113.432 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.56 8.82 23.36 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.918 0.389 . . . . 4.9500000000000002 111.713 -179.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.52 74.24 47.22 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.643 -0.253 . . . . 3.1600000000000001 110.349 179.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 213' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -64.37 -55.71 0.54 Allowed 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.47 2.113 . . . . 4.0300000000000002 112.374 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.227 0 CA-C-O 118.254 -0.879 . . . . 5.5700000000000003 109.359 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.942 0 CA-C-O 121.068 0.461 . . . . 5.4699999999999998 110.657 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -123.7 124.7 43.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.379 -0.373 . . . . 5.3399999999999999 110.393 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.2 m -105.16 124.58 49.77 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.712 -0.477 . . . . 2.73 109.712 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 m -84.89 -42.86 14.62 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.855 0.359 . . . . 3.2400000000000002 111.403 -179.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -88.91 33.74 0.78 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.13 0.49 . . . . 2.8999999999999999 111.301 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -65.25 -31.89 73.27 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.745 -0.661 . . . . 2.75 110.874 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -91.37 -38.05 12.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.961 -0.563 . . . . 0.91000000000000003 110.634 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.84 -44.26 94.16 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.731 -0.668 . . . . 0.85999999999999999 112.487 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 4.5 t -68.33 -26.85 65.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.645 0.259 . . . . 1.4199999999999999 111.236 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.516 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 29.8 mmmt -68.8 -36.15 77.9 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 120.805 0.336 . . . . 1.3 110.146 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 42.9 mt -67.54 -34.84 77.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.913 -0.585 . . . . 1.5700000000000001 110.669 179.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 -70.12 -31.28 68.74 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.75 -0.659 . . . . 1.5900000000000001 111.621 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.5 t -104.09 16.52 26.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.751 0.31 . . . . 1.6299999999999999 111.81 -179.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 11' ' ' LYS . 8.1 mt -73.73 176.4 6.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.101 0.477 . . . . 1.1000000000000001 111.342 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.46 ' HG2' ' H ' ' A' ' 17' ' ' ASP . 5.6 tt0 -146.25 168.8 20.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.715 -0.675 . . . . 2.1600000000000001 109.552 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.46 ' H ' ' HG2' ' A' ' 16' ' ' GLU . 5.2 p-10 -84.16 10.26 10.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.193 0.521 . . . . 1.9399999999999999 110.089 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.471 ' O ' HG12 ' A' ' 22' ' ' ILE . 1.4 t -77.16 129.04 35.45 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.509 -0.769 . . . . 1.6100000000000001 110.53 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.59 ' OE1' ' HA ' ' B' ' 208' ' ' TYR . 3.2 mt-30 -65.34 -33.2 75.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.494 0.664 . . . . 2.6400000000000001 109.841 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -66.93 -46.43 74.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.986 -1.006 . . . . 2.9900000000000002 111.096 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.6 p -69.14 -39.48 78.83 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 121.071 -0.252 . . . . 1.1000000000000001 111.46 -179.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 18' ' ' SER . 39.7 mm -59.25 -45.24 93.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 120.765 0.317 . . . . 0.88 110.383 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 t -63.97 -29.91 71.03 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.175 -0.466 . . . . 1.1799999999999999 110.531 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.0 m -68.62 -31.12 70.06 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.134 -0.485 . . . . 1.1599999999999999 110.399 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.15 -44.88 28.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.921 -0.582 . . . . 0.45000000000000001 110.681 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.7 p -64.96 -33.18 75.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.313 -0.403 . . . . 1.3200000000000001 110.673 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.438 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -63.1 -33.15 74.83 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.256 -0.429 . . . . 2.3799999999999999 110.734 179.374 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 17.4 t90 -79.87 -34.51 39.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.05 0.452 . . . . 0.97999999999999998 109.946 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.1 mp -63.78 -41.23 97.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.989 -0.55 . . . . 1.3 110.923 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.478 HD12 HE21 ' A' ' 70' ' ' GLN . 17.0 mt -64.59 -21.08 66.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.459 -0.337 . . . . 1.0600000000000001 111.803 -179.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 27' ' ' LYS . 79.1 mt -76.24 -32.23 58.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.837 0.351 . . . . 1.71 110.634 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -105.19 59.8 0.68 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.671 0.748 . . . . 1.51 109.791 179.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 28.1 p90 -60.85 -21.34 63.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.137 -0.938 . . . . 1.6100000000000001 111.831 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 66.7 mtt180 -77.86 -12.35 59.97 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.075 0.464 . . . . 3.9700000000000002 110.506 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.34 7.09 44.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.044 -0.525 . . . . 1.7 110.492 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.466 ' N ' ' HD2' ' A' ' 37' ' ' PRO . . . -51.31 -52.57 58.02 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-N 115.518 -0.765 . . . . 0.42999999999999999 112.316 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 36' ' ' ALA . 21.7 Cg_endo -61.76 -31.71 85.93 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 121.853 1.702 . . . . 0.5 112.227 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 42' ' ' MET . 47.3 mtpt -73.17 -51.08 19.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.942 -0.572 . . . . 2.7799999999999998 111.174 -179.205 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 28.0 m -67.96 -27.07 36.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 120.998 -0.281 . . . . 0.39000000000000001 110.931 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.32 -51.44 60.61 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.934 0.397 . . . . 0.32000000000000001 110.527 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -70.06 -34.94 73.84 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.382 -0.372 . . . . 1.3999999999999999 110.12 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.429 ' HB2' ' O ' ' A' ' 38' ' ' LYS . 14.4 ttm -61.96 -42.22 98.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.972 -0.558 . . . . 1.51 109.655 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 53.4 t90 -63.35 -49.95 71.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.228 -0.896 . . . . 0.40999999999999998 110.191 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.512 ' HE2' HD12 ' A' ' 48' ' ' LEU . 11.9 tmtt? -58.16 -46.51 85.58 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.764 -0.653 . . . . 1.1100000000000001 110.949 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.506 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 64.7 mm-40 -61.54 -47.35 85.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.029 -0.532 . . . . 1.96 111.7 -179.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -65.39 -45.7 82.95 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.177 -0.465 . . . . 1.5800000000000001 111.152 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 72.9 mmm -63.4 -28.39 69.95 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.196 0.443 . . . . 0.69999999999999996 112.196 -178.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.512 HD12 ' HE2' ' A' ' 44' ' ' LYS . 15.4 mt -97.26 14.99 24.1 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 111.927 0.343 . . . . 0.88 111.927 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.506 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 79.5 mtt180 -89.29 139.76 28.56 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 110.301 -0.259 . . . . 2.6899999999999999 110.301 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.08 -18.32 27.49 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.942 2.428 . . . . 0.93999999999999995 112.685 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.23 -7.15 56.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.211 0.529 . . . . 1.3300000000000001 111.252 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.2 t -97.81 125.27 51.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.034 -0.53 . . . . 0.58999999999999997 110.853 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -74.49 152.71 39.36 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.695 -0.684 . . . . 1.8 110.015 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -34.64 64.07 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.12 0.415 . . . . 0.81000000000000005 112.12 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.59 -34.47 78.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.845 0.355 . . . . 3.5800000000000001 110.671 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.4 mmt-85 -74.4 -33.47 63.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.381 -0.372 . . . . 3.0499999999999998 110.299 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 57.4 mttt -65.44 -32.28 73.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.08 -0.509 . . . . 0.58999999999999997 109.956 179.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 75.3 mt -63.94 -43.13 96.8 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.397 -0.594 . . . . 1.26 109.397 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.5 mp -64.78 -41.53 95.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.395 -0.82 . . . . 1.54 110.068 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.31 -36.6 93.41 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.884 -0.674 . . . . 0.37 111.458 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 49.1 tp -69.79 -36.14 75.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.998 0.428 . . . . 1.23 110.065 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 9.8 m-30 -61.59 -40.11 93.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.706 -0.679 . . . . 1.3799999999999999 110.648 179.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.75 -40.78 98.32 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.917 -0.583 . . . . 1.45 110.539 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.485 ' O ' HG22 ' A' ' 68' ' ' VAL . 13.4 tmm? -61.5 -51.39 68.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.357 -0.383 . . . . 0.60999999999999999 110.441 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.444 ' O ' ' HB2' ' A' ' 69' ' ' GLN . 13.5 t30 -58.92 -35.91 73.85 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.968 0.413 . . . . 1.6899999999999999 111.086 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.469 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 1.9 t-80 -74.84 -50.42 17.14 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.302 -0.408 . . . . 1.54 111.804 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 9.9 p -60.18 -39.28 80.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 112.092 0.404 . . . . 1.3999999999999999 112.092 -178.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.485 HG22 ' O ' ' A' ' 64' ' ' MET . 33.6 m -75.01 -24.18 17.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 120.769 -0.372 . . . . 0.42999999999999999 111.03 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.444 ' HB2' ' O ' ' A' ' 65' ' ' ASN . 3.0 tp-100 -67.91 -49.53 61.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.111 0.481 . . . . 2.02 110.151 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.478 HE21 HD12 ' A' ' 30' ' ' LEU . 9.2 pt20 -82.89 -14.95 53.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.793 -0.64 . . . . 2.1000000000000001 111.202 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.64 -38.67 91.79 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 120.994 0.426 . . . . 0.51000000000000001 110.191 179.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -68.76 -25.65 64.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.66 -0.7 . . . . 2.0899999999999999 110.383 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.19 -31.06 79.44 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 111.067 -0.813 . . . . 0.66000000000000003 111.067 178.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -99.02 -3.19 35.42 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.205 -0.665 . . . . 1.6200000000000001 109.205 178.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.0 mttp 57.84 40.09 26.32 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 114.696 -1.138 . . . . 2.7000000000000002 112.05 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 24.3 mm -90.99 90.8 3.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.585 -0.524 . . . . 0.63 109.585 179.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 18.5 pt -66.85 -14.19 17.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.863 -0.608 . . . . 0.85999999999999999 111.689 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -58.48 -44.16 89.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.876 0.369 . . . . 2.2200000000000002 110.254 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -70.96 -37.33 72.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.129 -0.487 . . . . 1.3400000000000001 110.444 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -62.12 -37.42 85.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.911 -0.586 . . . . 1.3 110.851 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -80.26 -46.81 15.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.535 -0.302 . . . . 1.3200000000000001 110.677 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.557 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 66.1 m -57.65 -52.1 66.82 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.057 -0.52 . . . . 0.93999999999999995 111.786 -179.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -82.44 -21.01 35.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.547 -0.297 . . . . 1.23 111.485 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -64.4 -51.3 53.67 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.861 -0.685 . . . . 0.34000000000000002 113.491 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.557 ' HE2' ' HA ' ' A' ' 82' ' ' SER . 25.9 pttt -68.15 -12.77 61.49 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.776 0.658 . . . . 1.3100000000000001 112.776 -178.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 33.1 m -109.35 -16.03 9.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 120.719 -0.392 . . . . 0.38 111.417 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.14 87.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.358 -0.383 . . . . 0.38 111.1 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.86 -38.82 83.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.056 -0.52 . . . . 0.45000000000000001 110.95 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -63.84 -52.91 57.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.745 -0.662 . . . . 1.5600000000000001 110.614 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.53 ' O ' HG12 ' A' ' 94' ' ' ILE . 99.6 t -65.38 -45.2 93.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.822 -0.627 . . . . 0.34000000000000002 111.265 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -58.49 -45.09 89.43 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.732 0.301 . . . . 1.45 111.268 -179.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -68.17 -26.06 74.27 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.729 -0.748 . . . . 0.40999999999999998 112.505 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 4.8 mmm-85 -85.54 -46.97 10.33 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.862 0.319 . . . . 3.46 111.862 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 90' ' ' VAL . 43.1 pt -65.84 -26.86 39.67 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 C-N-CA 121.119 -0.232 . . . . 0.5 111.371 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 60.7 t30 -62.27 -26.74 68.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.062 0.458 . . . . 1.0 110.493 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -81.67 -35.59 29.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.065 -0.516 . . . . 1.1399999999999999 110.422 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -81.34 -30.04 33.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.834 -0.621 . . . . 1.3300000000000001 111.396 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.411 ' HA ' ' HD3' ' A' ' 99' ' ' PRO . 8.2 m-30 -81.37 118.54 72.7 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 116.043 -0.526 . . . . 1.3899999999999999 111.613 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 98' ' ' PHE . 25.8 Cg_exo -64.35 -177.41 0.5 Allowed 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.91 2.406 . . . . 1.47 111.582 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 67.7 mtm-85 -51.08 -49.48 60.56 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.114 0.483 . . . . 4.8700000000000001 111.422 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.51 -39.23 79.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.42 -0.809 . . . . 2.5800000000000001 112.899 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 32.4 mt -86.91 -34.0 19.53 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.098 0.777 . . . . 0.84999999999999998 113.098 -177.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . 0.549 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 0.4 OUTLIER -68.2 -20.97 64.88 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.681 -0.408 . . . . 2.3599999999999999 111.115 -179.407 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -70.15 -21.69 63.05 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.064 0.459 . . . . 2.5699999999999998 109.906 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 42.7 mttm -77.91 -45.94 22.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.659 -0.701 . . . . 2.4399999999999999 110.653 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 103' ' ' LYS . 4.0 pp -65.11 -24.69 67.5 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 110.148 -0.316 . . . . 1.27 110.148 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 60.3 m -60.95 -37.75 83.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.111 0.481 . . . . 1.1499999999999999 110.152 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 28.0 ttm180 -72.95 -37.29 67.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.88 -0.6 . . . . 3.6000000000000001 109.724 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 60.3 t -62.85 -49.43 83.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.711 -0.677 . . . . 1.25 110.411 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.549 HG21 HD11 ' A' ' 131' ' ' LEU . 93.3 t -59.48 -36.61 65.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.746 -0.661 . . . . 1.1100000000000001 110.595 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -59.91 -54.28 48.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.165 -0.471 . . . . 1.74 110.467 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 55.8 mt -62.09 -40.14 86.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.94 -0.573 . . . . 1.21 110.879 -179.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.47 ' HA ' ' CG1' ' A' ' 118' ' ' ILE . 5.6 mp -63.82 -34.71 78.52 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.885 -0.598 . . . . 1.3300000000000001 112.323 -179.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.6 ptmm? -90.27 -37.94 13.75 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.417 0.525 . . . . 1.6899999999999999 112.417 -178.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -72.94 -36.03 67.11 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.347 0.499 . . . . 2.2000000000000002 112.347 -178.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -95.05 5.62 51.37 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.947 -0.301 . . . . 3.23 111.298 -178.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 51.51 71.23 0.46 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.445 0.64 . . . . 2.0 110.629 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.47 ' CG1' ' HA ' ' A' ' 113' ' ' LEU . 30.3 mm -83.94 -42.8 17.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.77 -0.65 . . . . 0.60999999999999999 110.288 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -115.07 177.94 4.47 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.075 -0.511 . . . . 1.26 110.051 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.2 t -68.7 159.89 31.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.375 -0.375 . . . . 1.3 110.464 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 45.4 mtmt -56.46 -41.53 76.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.872 -0.604 . . . . 2.8500000000000001 111.573 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -61.89 -37.61 85.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.012 -0.54 . . . . 2.9500000000000002 110.497 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.459 ' O ' HG13 ' A' ' 127' ' ' ILE . 68.1 t -70.95 -46.15 69.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.961 -0.563 . . . . 1.28 110.462 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.415 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 88.0 t -56.35 -46.78 81.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.153 -0.476 . . . . 1.23 110.62 179.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -63.03 -36.29 83.08 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.816 -0.629 . . . . 1.74 110.844 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -67.9 -40.06 83.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 1.4399999999999999 110.305 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 123' ' ' VAL . 85.3 mt -63.72 -47.08 92.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.187 -0.46 . . . . 0.46999999999999997 110.272 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 124' ' ' VAL . 43.8 mt-10 -58.23 -50.87 72.04 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.867 -0.606 . . . . 2.0499999999999998 111.286 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 12.0 ptm180 -64.81 -26.03 68.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.432 -0.349 . . . . 3.98 111.599 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 74.0 m -68.47 -37.42 80.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.074 0.464 . . . . 0.69999999999999996 110.343 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.549 HD11 HG21 ' A' ' 110' ' ' VAL . 29.5 mt -76.43 -41.87 46.07 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.856 -0.611 . . . . 1.3300000000000001 110.595 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.03 99.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.853 -0.612 . . . . 0.68999999999999995 111.8 -179.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.47 -30.44 71.56 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.256 -0.429 . . . . 0.83999999999999997 111.427 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.34 -21.19 64.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 1.1200000000000001 110.887 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 71.7 mt -99.28 3.13 46.07 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.074 -0.512 . . . . 4.04 110.403 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -99.36 29.03 4.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.898 -0.592 . . . . 6.6399999999999997 110.474 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 9.1 t60 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.405 -0.807 . . . . 8.0 110.306 179.828 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 206' ' ' PRO . . . . . 0.444 ' HG2' ' HB2' ' A' ' 18' ' ' SER . 31.4 Cg_exo . . . . . 0 CA--C 1.532 0.391 0 N-CA-C 113.006 0.348 . . . . 7.4699999999999998 113.006 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 17.5 m 63.35 93.68 0.05 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.441 0.638 . . . . 6.0199999999999996 112.354 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . 0.59 ' HA ' ' OE1' ' A' ' 19' ' ' GLN . 34.7 t80 -75.93 131.15 39.45 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.981 -0.554 . . . . 4.0700000000000003 111.235 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 209' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -58.95 -27.19 84.04 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.318 2.012 . . . . 4.3499999999999996 112.102 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.63 7.15 47.24 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.801 -0.636 . . . . 4.9500000000000002 110.825 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 212' ' ' SER . . . . . . . . . . . . . 54.4 m -136.92 87.69 19.06 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 3.1600000000000001 110.586 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 213' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.74 -62.73 0.23 Allowed 'Trans proline' 0 CA--C 1.531 0.372 0 C-N-CA 123.26 2.64 . . . . 4.0300000000000002 113.465 -179.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 67.0 m . . . . . 0 C--O 1.244 0.805 0 CA-C-O 118.54 -0.743 . . . . 5.5700000000000003 110.064 -179.842 . . . . . . . . 0 0 . 1 stop_ save_