data_5mmc_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 5mmc _Structure_validation_residue.Date_analyzed 2017-03-07 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 ' 27' ' ' LYS . . . . . . . . . . . . . 17.2 pttp . . . . . 0 CA--C 1.531 0.227 0 CA-C-O 120.644 0.259 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.473 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 82.8 mtm-85 -67.8 -44.06 78.23 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 176.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.534 ' O ' HG22 ' A' ' 33' ' ' VAL . 87.6 t -61.41 -38.5 80.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.745 175.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.2 t -58.32 -45.66 87.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.413 177.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -61.87 -36.6 81.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.22 178.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.39 -45.25 55.88 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.235 -179.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.534 HG22 ' O ' ' A' ' 29' ' ' VAL . 94.7 t -62.4 -40.0 86.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.764 -178.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -68.92 -38.75 79.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.796 0.331 . . . . 0.0 110.753 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -71.74 -42.6 67.06 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.745 -178.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.534 ' HB2' HG11 ' A' ' 70' ' ' VAL . 89.8 mt -67.28 -30.92 70.93 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.155 179.448 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.6 mt -85.32 6.04 28.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.565 -179.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.626 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 12.2 t70 -73.94 128.91 36.77 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -53.52 -44.0 68.78 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -175.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 86.1 mtm180 -69.11 -33.59 73.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.292 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.525 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 98.5 t -73.59 -28.68 25.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.159 0.504 . . . . 0.0 110.419 178.022 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.626 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 90.9 mtt180 -62.43 -22.26 66.05 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.042 0.449 . . . . 0.0 110.322 173.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 34.9 ttm180 -93.46 -17.07 23.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.332 -177.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.6 p -80.31 158.32 71.91 Favored Pre-proline 0 C--N 1.33 -0.277 0 O-C-N 122.269 -0.269 . . . . 0.0 110.654 174.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.401 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 36.9 Cg_endo -67.05 156.3 66.95 Favored 'Trans proline' 0 C--O 1.234 0.324 0 C-N-CA 122.595 2.196 . . . . 0.0 112.234 178.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.49 ' O ' HG21 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -59.66 -37.91 80.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.924 -177.996 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.6 p -58.42 -42.77 87.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.466 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.9 m -63.97 -42.68 97.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.118 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.525 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 78.4 mttt -60.88 -49.45 77.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.284 178.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.49 HG21 ' O ' ' A' ' 46' ' ' THR . 63.7 t -65.18 -44.62 95.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.187 -174.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 15.7 m170 -63.31 -37.83 88.79 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.217 -177.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -70.57 -45.57 65.15 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.897 -178.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 91.8 mt -61.99 -40.19 94.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.049 -178.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.479 ' HD2' ' C ' ' A' ' 54' ' ' LYS . 0.9 OUTLIER -59.77 -43.7 94.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.323 0.583 . . . . 0.0 109.888 177.521 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.4 m -68.7 -14.36 62.97 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.396 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 35.5 mtpt -87.58 3.67 46.67 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.949 177.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.72 2.4 52.76 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.994 174.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.473 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.8 mp -78.24 154.66 30.83 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.372 0.606 . . . . 0.0 111.663 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.402 ' O ' HG13 ' A' ' 63' ' ' ILE . 16.2 m -95.9 161.22 14.09 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.309 173.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.9 -38.66 76.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.855 0.359 . . . . 0.0 111.284 -177.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.02 -37.42 87.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.988 178.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -71.53 -39.26 70.85 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.386 -179.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 59' ' ' SER . 80.6 mt -63.16 -43.96 99.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.189 176.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 40.7 t -56.71 -42.19 78.73 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.913 177.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -68.18 -48.54 64.99 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.917 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.21 -41.91 80.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.403 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -58.81 -46.58 87.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.95 0.405 . . . . 0.0 110.83 176.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 20.8 m -65.21 -33.05 75.08 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.108 0.48 . . . . 0.0 110.081 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -63.28 -35.77 81.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.642 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.534 HG11 ' HB2' ' A' ' 36' ' ' LEU . 23.0 m -88.46 5.23 4.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-O 120.992 0.425 . . . . 0.0 111.643 -177.279 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 93.53 18.89 36.8 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.662 177.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -121.58 91.01 48.37 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.55 99.46 1.22 Allowed 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 121.982 1.788 . . . . 0.0 112.368 -177.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -109.85 144.29 38.51 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.645 176.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.413 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 24.3 p -81.79 157.81 24.35 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 175.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 53.6 tp -60.78 -32.66 71.97 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.107 0.479 . . . . 0.0 110.568 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -59.78 -42.19 92.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.745 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.435 ' O ' HG13 ' A' ' 82' ' ' ILE . 58.1 mm-40 -59.47 -48.66 80.79 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.291 178.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 46.1 mm -60.36 -48.41 88.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.037 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -63.48 -38.14 90.0 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.861 0.362 . . . . 0.0 110.648 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.6 ttm180 -61.95 -48.71 79.17 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.924 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 78' ' ' GLU . 69.2 mt -64.34 -33.09 60.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.072 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 79.2 mt -79.2 -17.25 55.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.766 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.6 p . . . . . 0 C--O 1.252 1.206 0 CA-C-O 118.308 -0.853 . . . . 0.0 110.621 179.598 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.8 pttt . . . . . 0 C--O 1.227 -0.099 0 CA-C-O 120.692 0.282 . . . . 0.0 110.598 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.425 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 83.3 mtm180 -69.93 -40.4 75.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.66 -179.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.489 ' O ' HG23 ' A' ' 33' ' ' VAL . 84.6 t -62.49 -42.24 95.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 175.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.6 t -61.95 -42.36 99.03 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.49 178.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -61.37 -36.88 81.46 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 121.268 0.556 . . . . 0.0 110.472 177.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.423 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -73.34 -44.74 58.26 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.05 179.443 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 29' ' ' VAL . 78.2 t -60.81 -43.21 94.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.403 -179.267 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -68.23 -34.61 76.55 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.686 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -72.78 -43.59 62.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.657 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.533 ' HB2' HG12 ' A' ' 70' ' ' VAL . 94.8 mt -68.47 -32.16 71.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.111 0.481 . . . . 0.0 111.327 -178.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.9 mt -86.4 7.05 27.28 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.433 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.601 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 9.5 t70 -81.59 134.8 35.54 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.4 p -56.64 -32.9 65.79 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.696 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -68.13 -43.07 79.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.133 0.492 . . . . 0.0 110.571 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.41 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.5 t -78.04 -24.14 13.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.072 -175.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.601 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 83.9 mtt180 -60.97 -21.8 63.86 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.906 0.384 . . . . 0.0 110.358 173.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -85.69 -18.79 32.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.261 -177.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 p -88.32 155.81 51.48 Favored Pre-proline 0 C--N 1.328 -0.369 0 O-C-N 122.439 -0.163 . . . . 0.0 111.155 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.42 156.32 65.86 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.757 2.304 . . . . 0.0 112.04 176.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.438 ' O ' HG22 ' A' ' 50' ' ' VAL . 2.2 m -60.06 -40.17 88.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.476 -176.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.6 m -58.55 -38.39 77.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.015 -177.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.1 m -65.55 -45.17 84.41 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.629 177.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.557 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 82.1 mttt -57.34 -48.59 78.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.058 178.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.438 HG22 ' O ' ' A' ' 46' ' ' THR . 57.9 t -63.84 -46.02 95.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.191 -177.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 17.0 m170 -64.53 -39.5 93.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.81 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -66.2 -42.72 88.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.097 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 67.3 mt -63.69 -34.76 78.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.804 178.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.451 ' HD3' HD23 ' A' ' 83' ' ' LEU . 33.8 ttpt -61.09 -44.36 97.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.805 0.336 . . . . 0.0 110.222 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.4 p -72.41 -12.98 61.34 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.515 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -81.98 1.35 35.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.859 0.361 . . . . 0.0 110.936 176.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 93.98 14.43 52.03 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.364 178.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.425 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 5.9 mp -91.49 147.99 22.62 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.013 0.435 . . . . 0.0 111.589 179.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.427 ' O ' HG13 ' A' ' 63' ' ' ILE . 1.9 m -92.72 173.25 7.86 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.006 173.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.87 -36.01 76.0 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.712 0.292 . . . . 0.0 111.087 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.7 mp0 -66.43 -45.23 80.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.919 -179.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -62.88 -43.32 99.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.523 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.427 HG13 ' O ' ' A' ' 59' ' ' SER . 78.2 mt -63.08 -45.12 99.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.649 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.5 t -57.78 -45.2 86.33 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.213 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.679 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 33.4 tt0 -67.35 -47.64 69.85 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.602 -178.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.89 -45.38 82.59 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.137 -178.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.564 ' O ' HG22 ' A' ' 70' ' ' VAL . 2.7 m-85 -57.98 -42.23 84.64 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.193 178.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.1 m -67.16 -33.29 75.1 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.177 0.513 . . . . 0.0 110.416 -177.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.679 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 20.1 mtpp -72.39 -29.79 64.07 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.986 -179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.564 HG22 ' O ' ' A' ' 67' ' ' PHE . 10.8 m -83.75 0.27 4.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.854 0.359 . . . . 0.0 111.534 -178.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 96.13 18.33 31.84 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.42 178.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -127.46 91.15 46.7 Favored Pre-proline 0 C--N 1.323 -0.587 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -73.72 93.78 0.86 Allowed 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 121.992 1.795 . . . . 0.0 112.817 -175.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.408 ' HE3' HG22 ' A' ' 46' ' ' THR . 74.2 mmtt -103.65 137.46 41.67 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.482 175.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.439 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 70.0 p -77.47 162.92 26.8 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.263 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 44.3 tp -62.53 -32.63 73.6 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.119 -0.696 . . . . 0.0 109.119 175.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -60.35 -46.32 90.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.818 176.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.439 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 36.7 mm-40 -59.57 -45.88 90.55 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.09 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.405 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 39.4 mm -60.21 -46.78 94.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.524 -177.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -64.39 -39.52 94.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.932 0.396 . . . . 0.0 110.659 177.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.9 tpp180 -60.18 -46.55 89.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.393 177.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.5 mt -67.93 -31.99 54.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.202 -178.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.451 HD23 ' HD3' ' A' ' 54' ' ' LYS . 91.8 mt -82.64 -4.03 57.13 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.741 0.305 . . . . 0.0 111.358 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 45.5 m . . . . . 0 C--O 1.252 1.208 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.614 177.513 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.4 pttt . . . . . 0 CA--C 1.531 0.229 0 CA-C-O 120.535 0.207 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.1 mtm-85 -70.47 -41.13 73.14 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 122.29 -0.256 . . . . 0.0 111.572 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.432 ' O ' HG22 ' A' ' 33' ' ' VAL . 75.2 t -66.01 -39.37 84.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 121.066 -0.253 . . . . 0.0 110.537 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.9 m -58.6 -40.59 83.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.71 0.29 . . . . 0.0 110.49 176.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.426 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 29.8 m-80 -66.55 -36.29 82.31 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.957 177.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.467 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -72.38 -45.22 60.76 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.441 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.488 HG21 ' HE3' ' A' ' 69' ' ' LYS . 78.2 t -61.36 -41.46 89.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.623 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 11.2 pt-20 -68.4 -33.64 74.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 0.0 110.658 178.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -71.88 -43.57 65.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.627 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.514 ' HB2' HG13 ' A' ' 70' ' ' VAL . 96.5 mt -67.75 -30.3 69.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.248 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.8 mt -85.82 4.24 38.01 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.018 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.551 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 18.4 t70 -75.04 132.81 41.58 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 177.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.5 m -53.66 -39.98 65.5 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 -174.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -69.17 -47.47 64.85 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.036 0.445 . . . . 0.0 110.327 178.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.3 t -66.65 -25.64 35.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.975 -177.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.551 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 83.0 mtp180 -65.52 -22.13 66.69 Favored 'General case' 0 C--N 1.319 -0.737 0 O-C-N 122.151 -0.343 . . . . 0.0 111.371 175.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 74.9 mtm180 -101.67 6.99 42.17 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -175.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.457 HG21 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -96.14 169.92 8.32 Favored Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 175.116 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.457 ' HD2' HG21 ' A' ' 44' ' ' THR . 57.2 Cg_endo -71.05 157.53 57.56 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.335 2.023 . . . . 0.0 111.906 175.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.426 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.3 OUTLIER -68.5 -39.83 81.12 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.524 -176.82 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.8 m -58.86 -35.8 73.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.521 -175.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.44 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 70.1 m -64.06 -44.82 91.29 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.221 0.534 . . . . 0.0 110.915 179.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.466 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 24.5 mttm -63.56 -45.47 90.37 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.502 -178.047 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 77.8 t -62.51 -44.62 99.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.57 -177.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 31.1 m170 -64.84 -38.24 90.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.401 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.484 ' O ' ' HG3' ' A' ' 56' ' ' LYS . 55.8 t80 -68.82 -43.37 75.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.725 -179.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 76.8 mt -66.26 -38.7 88.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.756 0.312 . . . . 0.0 110.793 179.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -60.37 -40.6 91.42 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.242 0.544 . . . . 0.0 109.763 173.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.0 t -68.64 -20.03 64.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.244 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' A' ' 52' ' ' PHE . 28.9 mtpp -81.5 -7.83 59.64 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.904 177.047 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.95 10.55 39.65 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.832 178.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.8 mp -82.31 145.13 30.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.276 0.56 . . . . 0.0 111.77 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.448 ' O ' HG13 ' A' ' 63' ' ' ILE . 8.6 m -85.42 164.82 17.66 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.123 175.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.33 -35.44 71.9 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.137 0.494 . . . . 0.0 110.404 178.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -62.79 -48.94 76.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.703 177.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -64.9 -44.49 89.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.242 -177.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 59' ' ' SER . 73.2 mt -59.77 -41.79 86.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.258 178.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.1 t -59.31 -44.52 92.55 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.609 178.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -68.3 -45.92 71.72 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.192 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.56 -45.32 81.31 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.515 -178.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.558 ' O ' HG22 ' A' ' 70' ' ' VAL . 7.6 m-85 -59.95 -45.05 93.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.107 0.479 . . . . 0.0 110.934 178.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.0 m -64.82 -33.13 75.26 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.622 -178.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.488 ' HE3' HG21 ' A' ' 33' ' ' VAL . 20.1 mtmt -71.77 -32.14 67.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.652 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 67' ' ' PHE . 13.4 m -81.64 -3.83 7.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.714 0.292 . . . . 0.0 111.286 -177.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 100.01 18.21 22.97 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.298 179.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -126.6 90.94 48.59 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -73.63 97.18 0.95 Allowed 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 121.993 1.795 . . . . 0.0 112.748 -174.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.426 ' HE3' HG21 ' A' ' 46' ' ' THR . 74.3 mmtt -107.38 137.76 44.83 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.914 174.178 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.486 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 45.4 p -82.22 169.21 16.84 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.477 178.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.2 tp -62.9 -33.54 75.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.368 0.604 . . . . 0.0 109.811 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -60.27 -45.44 93.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.798 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.486 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 12.2 mm-40 -60.78 -47.15 87.63 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.052 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 42.6 mm -60.17 -46.15 94.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.805 -177.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 60.3 mttm -64.02 -40.06 95.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.363 . . . . 0.0 111.069 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -64.55 -43.61 93.4 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.74 178.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 72.7 mt -66.92 -31.73 54.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.618 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.9 mt -81.09 -6.85 59.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.482 177.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 14.4 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.433 -0.794 . . . . 0.0 109.746 177.175 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 120.585 0.231 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.543 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 82.7 mtm-85 -68.36 -44.23 75.68 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.862 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.552 ' O ' HG23 ' A' ' 33' ' ' VAL . 94.2 t -60.9 -41.94 90.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 110.027 -0.361 . . . . 0.0 110.027 177.173 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.0 t -60.64 -45.55 93.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.842 0.353 . . . . 0.0 110.404 178.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -62.86 -35.31 79.57 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.996 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.39 -44.73 64.4 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.152 179.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 29' ' ' VAL . 87.4 t -60.98 -42.69 93.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.56 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -68.65 -35.18 76.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.839 179.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -71.76 -43.25 66.09 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-O 120.925 0.393 . . . . 0.0 110.791 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.529 ' HB2' HG12 ' A' ' 70' ' ' VAL . 87.1 mt -65.24 -30.68 71.58 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.329 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.0 mt -85.72 7.47 23.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.979 -178.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.485 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 13.5 t70 -78.99 138.06 37.87 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 176.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.0 m -57.09 -39.63 75.39 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -176.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -68.22 -37.09 80.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.059 0.457 . . . . 0.0 110.412 -179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.545 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 70.7 t -75.13 -34.01 30.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.758 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 84.0 mtp180 -63.84 -21.14 66.3 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.03 0.443 . . . . 0.0 110.303 174.346 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -88.52 -17.49 30.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.026 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.5 p -85.52 159.7 55.18 Favored Pre-proline 0 C--N 1.329 -0.309 0 O-C-N 122.195 -0.316 . . . . 0.0 110.848 177.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.25 158.9 49.81 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.625 2.217 . . . . 0.0 112.021 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.452 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.3 OUTLIER -61.77 -39.6 92.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.541 -176.052 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.419 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 7.6 t -59.38 -43.1 92.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.765 -176.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.3 m -60.33 -42.89 96.57 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.021 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.545 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 79.9 mttt -60.26 -49.1 78.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.001 178.036 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 46' ' ' THR . 59.2 t -65.59 -44.26 93.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.809 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 22.5 m170 -63.9 -37.41 87.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.013 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -66.89 -44.36 81.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.463 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 89.0 mt -66.5 -41.15 89.31 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.887 -178.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.445 ' HD2' ' O ' ' A' ' 58' ' ' LEU . 42.4 tptt -62.84 -37.33 86.4 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.181 0.515 . . . . 0.0 109.926 176.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 35.5 t -70.98 -14.24 62.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.821 178.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 37.4 mtpt -91.46 2.1 56.66 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.998 0.428 . . . . 0.0 110.933 176.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.91 6.12 57.18 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.59 -0.814 . . . . 0.0 113.026 176.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.543 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.4 mp -73.19 153.0 40.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.201 0.524 . . . . 0.0 111.283 178.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.2 m -92.89 161.86 14.31 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.336 172.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.13 -42.61 86.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.798 0.332 . . . . 0.0 111.147 -177.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -62.16 -38.32 88.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.03 178.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.85 -41.98 86.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.048 0.451 . . . . 0.0 110.384 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.402 HG22 HG13 ' A' ' 50' ' ' VAL . 71.8 mt -63.6 -45.2 98.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.402 176.21 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 45.2 t -56.8 -42.6 79.79 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.016 178.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -66.35 -48.42 70.28 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.659 178.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.72 -47.91 78.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.093 -178.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.586 ' O ' HG22 ' A' ' 70' ' ' VAL . 5.2 m-85 -55.29 -46.83 76.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.022 0.439 . . . . 0.0 111.308 178.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.4 m -65.48 -32.63 74.34 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.961 0.41 . . . . 0.0 110.697 -177.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.449 ' HE3' HG22 ' A' ' 33' ' ' VAL . 21.8 mtmt -72.12 -28.88 63.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.769 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.586 HG22 ' O ' ' A' ' 67' ' ' PHE . 10.6 m -84.18 -1.21 6.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.08 0.467 . . . . 0.0 111.193 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.09 14.05 43.72 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.449 178.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -121.22 90.6 47.57 Favored Pre-proline 0 C--N 1.322 -0.615 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -70.87 105.2 1.62 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.012 1.808 . . . . 0.0 112.167 -175.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -116.35 138.39 51.37 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.791 176.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.1 p -82.03 159.28 23.51 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.34 179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 55.4 tp -61.7 -32.85 73.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.287 0.565 . . . . 0.0 109.661 177.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -57.01 -46.38 82.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.018 177.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.434 ' O ' HG13 ' A' ' 82' ' ' ILE . 38.3 mt-10 -63.33 -46.94 84.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.527 179.226 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 46.9 mm -59.93 -44.39 94.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.919 -176.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -63.77 -43.09 97.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.058 0.456 . . . . 0.0 110.773 178.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -63.33 -44.72 94.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.979 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 78' ' ' GLU . 96.4 mt -63.84 -36.64 77.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.101 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 75.5 mt -77.53 -25.39 50.19 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.289 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 7.1 t . . . . . 0 C--O 1.254 1.3 0 CA-C-O 118.181 -0.914 . . . . 0.0 109.996 -179.107 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.445 0.164 . . . . 0.0 111.015 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.479 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 88.4 mtm-85 -69.46 -39.55 77.67 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.908 0.385 . . . . 0.0 110.204 177.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.645 ' O ' HG23 ' A' ' 33' ' ' VAL . 71.2 t -62.75 -43.57 98.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.109 174.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 45.3 m -58.0 -45.86 86.16 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.749 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -61.66 -37.64 84.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.092 0.472 . . . . 0.0 110.928 178.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.49 -44.38 62.34 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.46 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 29' ' ' VAL . 67.7 t -61.07 -43.3 95.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.023 0.44 . . . . 0.0 110.355 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -69.22 -35.96 76.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.794 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -72.32 -43.48 64.09 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.834 0.35 . . . . 0.0 110.994 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.521 ' HB2' HG11 ' A' ' 70' ' ' VAL . 75.0 mt -63.61 -31.1 72.16 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.491 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.415 HD22 ' HA ' ' A' ' 37' ' ' LEU . 11.7 mt -85.89 6.99 25.83 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -178.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -77.07 139.38 39.99 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.717 -0.393 . . . . 0.0 109.989 177.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.542 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 14.5 m -57.89 -37.04 73.26 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.933 -175.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 33.4 mmt180 -69.57 -38.5 77.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.155 0.502 . . . . 0.0 110.587 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.575 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 58.2 t -74.5 -34.52 35.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.132 -176.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' A' ' 39' ' ' SER . 22.4 ptt180 -67.63 -21.37 65.39 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.877 0.37 . . . . 0.0 110.254 176.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -89.28 -7.11 56.1 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.686 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.4 p -96.96 158.4 33.46 Favored Pre-proline 0 C--N 1.326 -0.451 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.012 176.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -62.46 154.88 61.31 Favored 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.703 2.268 . . . . 0.0 111.95 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.431 ' O ' HG23 ' A' ' 50' ' ' VAL . 1.3 m -60.27 -35.63 75.96 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.859 -178.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.3 m -58.24 -42.87 87.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.786 -178.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.2 m -63.25 -45.74 90.15 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.873 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.575 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 82.2 mttt -57.46 -49.99 74.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.179 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 46' ' ' THR . 80.9 t -64.23 -43.54 97.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.925 -176.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 26.2 m170 -64.56 -37.48 87.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.081 -178.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -69.68 -42.68 73.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.387 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 68.7 mt -64.46 -39.26 93.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.674 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.415 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 29.8 tptt -63.87 -39.93 95.36 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 120.967 0.413 . . . . 0.0 110.102 176.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.2 t -69.63 -14.35 62.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.713 178.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -83.86 -1.61 54.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.793 176.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.42 17.92 47.72 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.627 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.479 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.4 mp -83.03 159.0 22.27 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.265 0.555 . . . . 0.0 111.043 177.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.1 m -100.59 165.23 11.51 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.438 -0.801 . . . . 0.0 108.897 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.95 -34.51 69.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.906 0.384 . . . . 0.0 110.821 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.97 -49.62 76.95 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.905 177.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -63.67 -43.64 96.12 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.902 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 78.5 mt -60.84 -44.96 98.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.715 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.6 t -60.81 -43.39 98.25 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.7 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.411 ' OE1' HG22 ' A' ' 29' ' ' VAL . 27.5 tt0 -68.85 -48.54 63.22 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.123 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.79 -41.57 82.39 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 120.726 0.298 . . . . 0.0 111.551 -178.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -60.93 -45.43 94.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.578 176.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 20.8 m -64.85 -34.33 78.11 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.043 0.449 . . . . 0.0 110.292 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.0 mmmt -63.14 -32.5 73.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.962 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.521 HG11 ' HB2' ' A' ' 36' ' ' LEU . 24.1 m -91.95 8.1 4.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.97 0.414 . . . . 0.0 111.401 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.41 23.7 33.34 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.794 177.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -126.61 91.31 47.71 Favored Pre-proline 0 C--N 1.32 -0.682 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 176.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -72.09 102.92 1.41 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 121.899 1.732 . . . . 0.0 111.744 -178.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -108.93 139.35 43.91 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.657 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 38.1 p -80.49 156.64 26.45 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.183 178.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 38.9 tp -63.25 -32.69 74.16 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.126 0.488 . . . . 0.0 109.943 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -60.36 -45.17 94.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.723 177.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -59.04 -47.58 84.72 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.511 177.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.0 mm -59.8 -45.19 95.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.433 -178.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.2 -44.99 93.79 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.868 0.366 . . . . 0.0 110.874 177.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.3 tpp180 -61.65 -47.22 86.38 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.943 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 86.3 mt -64.6 -34.45 69.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.765 -179.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 80.8 mt -81.61 -4.3 55.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.794 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 38.4 m . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.836 -0.602 . . . . 0.0 110.282 176.004 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt . . . . . 0 N--CA 1.456 -0.151 0 CA-C-O 120.514 0.197 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 51.6 mtm-85 -69.74 -40.23 76.3 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.52 0.2 . . . . 0.0 111.138 -177.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.643 ' O ' HG21 ' A' ' 33' ' ' VAL . 81.6 t -60.57 -43.7 95.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 175.103 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.3 m -62.16 -38.23 88.25 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.198 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.417 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 95.1 m-20 -61.79 -37.13 83.21 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.25 0.547 . . . . 0.0 110.382 177.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.05 -44.92 52.54 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.211 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.643 HG21 ' O ' ' A' ' 29' ' ' VAL . 61.8 t -61.58 -39.94 84.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.832 0.349 . . . . 0.0 110.544 -178.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 12.7 pt-20 -68.72 -38.46 80.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.91 178.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -72.38 -43.28 64.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.821 0.343 . . . . 0.0 110.935 -179.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.519 ' HB2' HG13 ' A' ' 70' ' ' VAL . 88.7 mt -66.15 -31.15 71.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.595 -177.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.3 mt -86.03 4.62 37.12 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.554 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 12.4 t70 -75.46 138.18 41.45 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.233 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.2 t -53.95 -37.71 64.17 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.389 -178.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 73.2 mtm180 -68.54 -46.52 69.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.393 0.616 . . . . 0.0 110.414 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.435 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.2 t -71.41 -29.46 35.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.209 -174.04 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.554 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 78.6 mtp180 -65.38 -21.96 66.74 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.213 177.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 25.2 mtm180 -90.12 -17.09 28.3 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.646 0.239 . . . . 0.0 111.646 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.3 p -83.64 159.17 61.59 Favored Pre-proline 0 C--N 1.326 -0.42 0 C-N-CA 121.238 -0.185 . . . . 0.0 110.89 177.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.44 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 35.8 Cg_endo -65.09 159.45 46.63 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.659 2.24 . . . . 0.0 112.512 177.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.403 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.7 OUTLIER -61.76 -39.73 92.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.22 -177.749 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 5.9 m -58.26 -40.96 83.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.278 -177.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 63.7 m -62.97 -46.64 86.76 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.736 177.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.531 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 80.7 mttt -56.99 -49.01 77.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.313 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 46' ' ' THR . 91.2 t -64.2 -45.02 97.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.268 -176.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 17.8 m170 -64.84 -38.93 92.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.017 -178.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -64.14 -42.93 96.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.277 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 87.7 mt -65.71 -37.97 87.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.848 -179.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -60.84 -42.24 97.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.005 174.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.4 t -69.59 -13.67 62.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.631 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.8 mmpt? -85.6 -3.04 58.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.626 175.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.1 17.37 40.68 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.637 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.2 mp -88.38 152.53 21.85 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.397 0.618 . . . . 0.0 111.934 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.2 m -93.52 164.91 13.0 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.743 175.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.23 -37.46 74.9 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.897 0.379 . . . . 0.0 110.839 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -62.44 -46.87 86.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.42 178.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -65.63 -40.5 92.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.621 -177.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 87.8 mt -64.64 -45.8 94.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.608 177.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 31.3 t -56.68 -44.76 81.78 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.165 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -68.27 -45.86 71.97 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.066 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 69' ' ' LYS . . . -57.76 -40.76 80.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.737 0.303 . . . . 0.0 111.473 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -60.04 -45.41 92.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.654 176.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.3 m -65.32 -33.08 75.13 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.229 0.538 . . . . 0.0 109.803 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 66' ' ' ALA . 27.0 mmmt -62.06 -35.77 79.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.937 177.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.519 HG13 ' HB2' ' A' ' 36' ' ' LEU . 22.1 m -89.89 5.37 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.822 0.344 . . . . 0.0 111.577 -176.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 94.66 13.5 53.31 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.875 176.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -119.42 90.81 43.21 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -72.43 102.31 1.37 Allowed 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 121.849 1.699 . . . . 0.0 112.053 -178.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -111.21 138.42 47.67 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.837 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 32.9 p -76.74 158.9 30.61 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.516 178.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 49.5 tp -62.99 -32.96 74.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.146 0.498 . . . . 0.0 109.947 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -58.72 -45.29 89.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.758 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.4 ' O ' HG13 ' A' ' 82' ' ' ILE . 45.2 mm-40 -59.14 -48.76 80.43 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.521 178.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.7 mm -60.51 -44.19 95.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.678 -177.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -63.14 -44.04 96.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.932 177.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -60.99 -43.0 99.47 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.109 178.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 78' ' ' GLU . 77.0 mt -66.68 -36.58 77.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.942 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 83.6 mt -77.74 -24.66 48.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.403 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 51.8 p . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.613 -0.708 . . . . 0.0 110.317 179.378 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.1 pttt . . . . . 0 N--CA 1.457 -0.091 0 CA-C-O 120.319 0.104 . . . . 0.0 110.9 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.445 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 29.0 mtm180 -62.52 -47.36 84.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.799 0.333 . . . . 0.0 110.379 178.124 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.475 ' O ' HG22 ' A' ' 33' ' ' VAL . 75.6 t -65.0 -39.89 87.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.075 177.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.0 m -58.04 -46.57 85.13 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.775 177.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -63.02 -36.47 83.68 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.172 178.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.68 -44.92 63.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.05 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.475 HG22 ' O ' ' A' ' 29' ' ' VAL . 82.2 t -61.18 -43.13 95.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.55 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -68.36 -35.53 77.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.9 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -72.43 -43.76 63.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.813 0.34 . . . . 0.0 110.677 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.526 ' HB2' HG12 ' A' ' 70' ' ' VAL . 86.6 mt -64.8 -29.95 70.94 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.563 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 19.6 mt -85.04 7.69 20.54 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.088 -176.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.651 ' OD2' ' HG2' ' A' ' 40' ' ' ARG . 9.4 t70 -85.37 139.06 31.86 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.104 177.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.649 ' O ' ' HG3' ' A' ' 43' ' ' ARG . 27.1 t -55.52 -41.15 72.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.238 -178.068 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.651 ' HG2' ' OD2' ' A' ' 38' ' ' ASP . 11.0 ptm180 -67.81 -32.56 73.21 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.035 0.445 . . . . 0.0 110.646 -177.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.555 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 98.8 t -78.98 -33.18 15.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.444 -178.34 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 82.7 mtp180 -66.56 -22.04 66.15 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.909 175.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.649 ' HG3' ' O ' ' A' ' 39' ' ' SER . 67.9 mtt180 -86.15 -18.32 32.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.464 -178.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.08 158.73 58.15 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 121.187 -0.205 . . . . 0.0 110.822 177.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.37 154.02 73.66 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.381 2.054 . . . . 0.0 112.015 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -34.43 73.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.952 -177.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.6 p -58.54 -43.1 89.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.843 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 62.0 m -64.78 -44.67 89.24 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.124 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.555 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 82.9 mttt -56.98 -49.38 75.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.078 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 62.3 t -67.73 -43.62 86.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.009 -176.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 25.2 m170 -65.04 -36.68 85.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.595 -177.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.441 ' O ' ' HG3' ' A' ' 56' ' ' LYS . 72.6 t80 -69.94 -45.45 67.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.45 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 98.9 mt -62.87 -40.84 98.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.075 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 46.5 tptt -62.96 -40.0 96.36 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.427 177.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.3 t -70.79 -13.78 62.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.637 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 52' ' ' PHE . 39.4 mtpt -86.12 -2.8 58.67 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.189 177.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 102.04 9.22 42.98 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.886 177.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.445 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.9 mp -80.6 156.01 26.62 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.44 0.638 . . . . 0.0 111.62 178.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.405 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 20.1 m -98.71 168.89 9.86 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.538 174.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.18 95.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.686 0.279 . . . . 0.0 111.113 -177.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -60.53 -40.85 93.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.938 177.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.405 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 6.3 mm-40 -63.1 -47.97 80.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.961 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 61.9 mt -64.65 -45.41 95.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.72 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.6 t -56.98 -45.02 83.25 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.946 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -67.76 -47.02 70.42 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.909 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.434 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -57.19 -47.26 81.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.052 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.563 ' O ' HG21 ' A' ' 70' ' ' VAL . 2.7 m-85 -56.44 -44.23 80.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.105 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.1 m -66.15 -33.54 76.01 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.807 0.337 . . . . 0.0 110.65 -177.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.41 ' HE3' HG21 ' A' ' 33' ' ' VAL . 22.4 mtmt -70.91 -30.95 67.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.795 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.563 HG21 ' O ' ' A' ' 67' ' ' PHE . 7.9 m -83.47 -0.83 5.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.848 0.356 . . . . 0.0 111.287 -177.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 96.28 19.87 26.91 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.483 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -127.81 91.3 45.57 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 177.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.84 101.14 1.15 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 121.892 1.728 . . . . 0.0 112.57 -175.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -109.46 139.35 44.55 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.044 176.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 34.7 p -82.45 164.55 20.89 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.113 176.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.1 tp -63.08 -32.73 74.18 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 176.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -59.52 -45.62 91.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.475 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -58.69 -46.94 86.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.216 178.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 41.6 mm -61.59 -45.36 98.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.786 -177.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -64.14 -39.53 94.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.998 0.428 . . . . 0.0 110.479 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -59.89 -48.63 80.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.898 177.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.3 mt -69.85 -33.37 55.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.828 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 75.5 mt -82.97 1.64 38.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.745 0.307 . . . . 0.0 111.598 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 26.2 t . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.577 -0.725 . . . . 0.0 109.264 176.026 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.6 pttt . . . . . 0 N--CA 1.455 -0.214 0 N-CA-C 110.387 -0.227 . . . . 0.0 110.387 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.459 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 21.2 mtm180 -65.46 -45.52 83.42 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.642 ' O ' HG21 ' A' ' 33' ' ' VAL . 73.3 t -60.63 -46.39 95.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.843 175.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.1 t -59.68 -42.83 93.82 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.171 -179.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -61.83 -36.85 82.39 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.051 0.453 . . . . 0.0 110.632 177.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.44 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -72.28 -41.86 66.21 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.878 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.642 HG21 ' O ' ' A' ' 29' ' ' VAL . 93.6 t -61.0 -46.55 96.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 120.869 0.366 . . . . 0.0 110.246 179.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -68.75 -33.65 74.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.815 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -71.42 -43.59 66.48 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.056 0.455 . . . . 0.0 110.615 179.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.558 ' HB2' HG12 ' A' ' 70' ' ' VAL . 93.2 mt -66.81 -32.24 73.4 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.884 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.2 mt -88.69 6.31 39.09 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -77.24 138.18 39.26 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.5 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 48.7 m -59.81 -33.93 72.39 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 -176.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.436 ' HG2' HG22 ' A' ' 41' ' ' VAL . 7.5 ptp180 -70.63 -40.58 73.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.069 0.461 . . . . 0.0 110.142 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.436 HG22 ' HG2' ' A' ' 40' ' ' ARG . 47.6 t -80.32 -26.96 11.7 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.856 -173.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.5 ' HG2' ' O ' ' A' ' 39' ' ' SER . 37.5 ptt180 -64.37 -20.29 66.03 Favored 'General case' 0 C--N 1.318 -0.799 0 O-C-N 121.738 -0.601 . . . . 0.0 111.222 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -83.43 -17.77 40.99 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -176.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.481 ' C ' ' HZ1' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -85.98 169.84 14.46 Favored Pre-proline 0 CA--C 1.536 0.442 0 O-C-N 122.44 -0.163 . . . . 0.0 111.348 -176.118 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.444 ' HD2' HG22 ' A' ' 44' ' ' THR . 44.2 Cg_endo -69.14 162.88 39.94 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.467 2.111 . . . . 0.0 112.191 174.455 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.46 -45.01 73.59 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.834 -176.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.1 m -58.44 -38.01 76.6 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.95 -174.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.8 m -60.27 -42.86 96.3 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 121.114 0.483 . . . . 0.0 110.873 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.481 ' HZ1' ' C ' ' A' ' 44' ' ' THR . 25.3 mttm -63.71 -45.0 91.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.516 -178.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 60.3 t -63.17 -43.25 98.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.653 -178.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -64.59 -37.62 88.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.658 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -67.27 -46.27 74.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.531 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 96.2 mt -61.86 -39.62 92.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.746 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 51.1 tptt -59.87 -42.81 94.53 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.518 175.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.0 t -70.97 -19.32 62.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.841 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 55.3 mmtt -82.04 -3.56 54.86 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.989 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 102.14 9.0 43.29 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.566 -0.826 . . . . 0.0 112.824 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.459 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.4 mp -82.55 149.36 27.54 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.381 0.61 . . . . 0.0 111.315 179.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.6 m -94.18 169.58 10.14 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.559 174.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.1 -37.78 77.96 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.861 0.363 . . . . 0.0 110.875 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.21 -44.85 92.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.401 177.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -63.17 -48.29 79.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.877 -178.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 61.3 mt -63.38 -43.54 98.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.946 -178.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 52.6 t -57.51 -44.1 84.75 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.848 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -68.57 -48.46 64.17 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.905 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.18 -41.11 78.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.883 -178.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.429 ' O ' HG23 ' A' ' 70' ' ' VAL . 6.6 m-85 -61.26 -45.9 92.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.849 0.357 . . . . 0.0 110.635 177.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.5 m -63.08 -35.35 79.95 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.105 0.479 . . . . 0.0 110.125 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 29.0 mmtt -60.93 -36.46 79.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.45 178.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.558 HG12 ' HB2' ' A' ' 36' ' ' LEU . 18.6 m -90.6 9.59 3.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.543 -175.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.62 16.07 57.32 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.799 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -121.75 90.64 48.39 Favored Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 177.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.07 95.86 0.85 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 121.955 1.77 . . . . 0.0 112.588 -176.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -103.63 137.72 41.29 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.678 175.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 41.7 p -77.68 161.72 27.56 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.136 177.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.452 ' HG ' ' HE3' ' A' ' 80' ' ' LYS . 62.6 tp -61.65 -32.94 73.13 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -60.34 -44.25 95.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.997 176.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -57.45 -49.13 77.25 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.088 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 41.1 mm -60.77 -41.83 89.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.449 -177.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.452 ' HE3' ' HG ' ' A' ' 76' ' ' LEU . 96.1 mttt -61.18 -44.08 97.87 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.151 177.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.0 tpp180 -62.58 -46.14 89.7 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.598 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 83.9 mt -65.3 -36.56 78.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.131 -178.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 72.2 mt -80.91 -4.57 55.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.617 0.246 . . . . 0.0 111.638 178.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 19.9 t . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.732 -0.652 . . . . 0.0 109.629 178.033 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt . . . . . 0 N--CA 1.456 -0.15 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -70.04 -41.55 74.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.344 178.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.457 ' O ' HG21 ' A' ' 33' ' ' VAL . 69.3 t -61.1 -44.52 98.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.09 174.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.3 m -60.84 -43.29 98.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.837 178.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -61.75 -35.84 79.28 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.068 0.461 . . . . 0.0 110.681 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.468 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -72.07 -44.8 62.74 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.953 178.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.457 HG21 ' O ' ' A' ' 29' ' ' VAL . 67.7 t -60.98 -43.42 96.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.684 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -67.88 -35.9 79.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.67 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -72.26 -43.7 63.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.902 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.539 ' HB2' HG12 ' A' ' 70' ' ' VAL . 93.1 mt -65.12 -31.35 72.5 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.453 -178.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.8 mt -85.79 -0.68 55.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.222 -0.444 . . . . 0.0 112.086 -176.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -69.26 138.18 53.71 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 11.8 m -63.05 -30.5 71.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.843 0.354 . . . . 0.0 111.526 -175.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -69.34 -38.3 78.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.365 0.603 . . . . 0.0 110.39 175.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.7 t -79.24 -36.35 18.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.251 -172.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -62.13 -20.28 63.91 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 120.859 0.361 . . . . 0.0 110.796 176.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 43' ' ' ARG . 40.7 ttm180 -85.21 -18.92 32.59 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.586 -178.51 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.484 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -89.13 168.38 15.54 Favored Pre-proline 0 CA--C 1.536 0.405 0 CA-C-N 116.85 -0.159 . . . . 0.0 110.989 -177.657 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.484 ' HD2' HG22 ' A' ' 44' ' ' THR . 49.2 Cg_endo -68.18 156.88 64.13 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.695 2.264 . . . . 0.0 111.975 176.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.419 HG22 ' HE3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -68.12 -33.97 75.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.065 -177.491 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.515 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 20.6 m -58.28 -40.75 82.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.518 -177.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 54.7 m -59.84 -48.02 83.36 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.089 178.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.471 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 2.2 mttp -58.17 -48.8 79.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.21 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 58.3 t -64.02 -41.58 92.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.747 -175.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -65.12 -39.28 92.85 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.368 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -65.18 -48.81 72.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.48 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 85.0 mt -62.68 -39.56 94.32 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.045 -177.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -60.51 -42.83 97.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.021 0.439 . . . . 0.0 110.236 175.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 45.7 m -68.77 -19.71 64.32 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.827 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -80.83 -8.22 59.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.732 176.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.52 8.32 37.99 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.826 177.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.5 mp -80.07 144.72 32.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.252 0.549 . . . . 0.0 111.842 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.429 ' O ' HG13 ' A' ' 63' ' ' ILE . 6.1 m -86.46 165.42 16.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.37 174.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.25 -38.8 84.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.994 0.426 . . . . 0.0 110.929 -178.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -65.49 -37.55 87.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.909 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -67.1 -48.05 69.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.54 177.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 59' ' ' SER . 73.7 mt -59.31 -44.89 93.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.537 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.4 t -56.61 -43.35 80.07 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.788 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.687 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 32.5 tt0 -67.93 -48.31 66.3 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.925 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.25 -43.77 79.02 Favored 'General case' 0 CA--C 1.519 -0.24 0 O-C-N 123.147 0.279 . . . . 0.0 110.965 -178.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.563 ' O ' HG21 ' A' ' 70' ' ' VAL . 7.0 m-85 -58.57 -43.88 89.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.944 0.402 . . . . 0.0 110.954 177.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.8 m -65.96 -33.13 75.11 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.112 0.482 . . . . 0.0 110.618 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.687 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 25.2 mtpp -72.33 -30.35 64.68 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.91 -179.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.563 HG21 ' O ' ' A' ' 67' ' ' PHE . 14.4 m -84.2 1.66 4.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.939 0.4 . . . . 0.0 111.201 -179.132 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.07 12.88 47.94 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.561 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -121.53 90.72 48.12 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.73 103.48 1.46 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 121.776 1.65 . . . . 0.0 112.001 -176.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.419 ' HE3' HG22 ' A' ' 46' ' ' THR . 71.3 mmtt -111.87 138.28 48.69 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.004 177.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 50.9 p -80.09 167.8 19.95 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.047 176.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.4 ' O ' ' HG3' ' A' ' 80' ' ' LYS . 47.4 tp -63.56 -32.66 74.19 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 176.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -59.22 -45.46 91.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.832 176.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -56.31 -49.08 75.33 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.33 179.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 39.7 mm -63.45 -48.8 85.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.835 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 76' ' ' LEU . 48.8 mttm -64.37 -39.63 94.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.41 -178.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -64.97 -44.69 88.54 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.116 0.484 . . . . 0.0 110.634 178.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.515 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 97.4 mt -65.48 -32.49 58.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.985 178.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 71.2 mt -79.36 -8.79 59.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.19 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 15.3 t . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.491 -0.766 . . . . 0.0 109.566 178.513 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.7 pttt . . . . . 0 CA--C 1.529 0.147 0 CA-C-O 120.433 0.159 . . . . 0.0 110.621 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.451 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 53.2 mtm180 -65.47 -48.0 74.17 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.705 0.288 . . . . 0.0 110.482 177.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.492 ' O ' HG21 ' A' ' 33' ' ' VAL . 76.5 t -61.74 -42.96 96.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.171 177.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.7 m -58.89 -45.66 89.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.908 178.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -62.0 -36.86 82.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.995 0.426 . . . . 0.0 111.135 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.75 -45.37 61.92 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.969 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.492 HG21 ' O ' ' A' ' 29' ' ' VAL . 90.6 t -61.22 -42.75 94.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.616 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.42 -35.82 76.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.168 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -71.21 -43.23 67.76 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.948 0.404 . . . . 0.0 110.553 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.522 ' HB2' HG13 ' A' ' 70' ' ' VAL . 88.9 mt -65.34 -29.19 69.89 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.284 179.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.8 mt -85.67 6.35 27.98 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.69 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 13.4 t70 -79.72 133.56 36.35 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.661 -0.415 . . . . 0.0 109.939 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.5 m -52.96 -38.96 62.58 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 123.495 0.497 . . . . 0.0 112.044 -175.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -69.61 -36.68 76.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.128 0.49 . . . . 0.0 110.742 -179.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.521 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 61.5 t -76.8 -21.81 14.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.464 0.649 . . . . 0.0 110.385 -178.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.69 ' HG2' ' O ' ' A' ' 38' ' ' ASP . 20.4 mmm180 -64.08 -25.81 68.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.256 173.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -91.64 -17.98 24.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.542 -173.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.4 p -82.71 158.41 65.49 Favored Pre-proline 0 C--N 1.326 -0.447 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.123 -177.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -65.5 153.96 75.84 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.444 2.096 . . . . 0.0 111.754 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.57 -37.62 78.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.196 -177.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.498 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 18.9 m -58.76 -41.3 86.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.379 -177.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.6 m -63.57 -44.6 93.63 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.851 178.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.521 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 81.5 mttt -58.12 -48.26 80.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.398 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 85.2 t -66.96 -45.08 88.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.427 -176.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -64.38 -35.81 82.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.784 -177.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -67.14 -46.1 75.12 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.389 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 94.7 mt -64.25 -37.88 89.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.784 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.422 ' HD3' HD23 ' A' ' 83' ' ' LEU . 29.6 ttpt -63.26 -39.31 94.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.02 0.438 . . . . 0.0 109.94 176.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 44.3 m -68.71 -15.77 63.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.91 179.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -85.24 -4.08 59.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.613 175.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.09 1.68 55.94 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.854 -0.688 . . . . 0.0 112.694 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.451 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.4 mp -71.67 148.55 46.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.099 0.476 . . . . 0.0 111.364 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.442 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 9.4 m -90.79 165.98 13.36 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.286 175.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.86 -39.55 78.04 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.677 0.275 . . . . 0.0 111.683 -177.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -67.76 -35.07 78.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.39 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.442 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 4.1 mm-40 -64.96 -45.2 86.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.473 0.654 . . . . 0.0 109.48 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 67.8 mt -62.81 -42.1 95.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.291 177.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 32.1 t -56.8 -46.64 81.46 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.343 177.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -67.67 -48.13 67.5 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.712 -178.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.81 -45.76 82.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.295 -178.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.551 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.1 m-85 -57.49 -45.1 85.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.898 0.38 . . . . 0.0 111.241 178.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.3 m -65.14 -33.23 75.52 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.94 0.4 . . . . 0.0 110.431 -177.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.419 ' HE3' HG23 ' A' ' 33' ' ' VAL . 21.3 mtmt -72.1 -27.73 62.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.607 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.551 HG22 ' O ' ' A' ' 67' ' ' PHE . 8.4 m -88.79 7.49 3.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.736 0.303 . . . . 0.0 111.657 -179.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 93.05 17.21 44.48 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.743 176.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -127.22 91.08 47.38 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -68.19 105.72 1.25 Allowed 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 122.006 1.804 . . . . 0.0 112.195 -176.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -116.41 139.12 50.77 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.836 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 21.6 p -87.46 167.59 13.85 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.302 176.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 51.6 tp -63.63 -33.35 75.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.19 0.519 . . . . 0.0 109.676 176.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -57.77 -45.73 85.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.692 177.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -57.73 -48.36 79.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.994 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 36.5 mm -63.72 -46.02 95.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.813 -175.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -60.96 -43.05 99.31 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.07 0.462 . . . . 0.0 110.298 177.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.5 tpp180 -60.05 -45.12 93.89 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.434 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.498 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 86.9 mt -67.39 -35.07 72.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.964 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.422 HD23 ' HD3' ' A' ' 54' ' ' LYS . 84.3 mt -82.1 -0.18 43.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.382 179.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 50.7 m . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.581 -0.723 . . . . 0.0 110.131 175.71 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt . . . . . 0 CA--C 1.523 -0.088 0 CA-C-O 120.527 0.203 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.548 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 60.2 mtm180 -63.84 -45.36 89.86 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.704 0.287 . . . . 0.0 110.626 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.481 ' O ' HG23 ' A' ' 33' ' ' VAL . 85.0 t -64.31 -41.44 92.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.415 177.184 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.4 m -62.08 -42.98 99.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.247 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -61.91 -35.65 79.0 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.172 0.51 . . . . 0.0 110.652 176.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.35 -44.91 61.93 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.243 179.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 29' ' ' VAL . 71.5 t -60.87 -43.23 95.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.861 0.362 . . . . 0.0 110.527 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -68.31 -36.0 78.67 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.728 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 92.9 t80 -72.09 -44.17 63.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.841 0.353 . . . . 0.0 110.634 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.537 ' HB2' HG13 ' A' ' 70' ' ' VAL . 86.3 mt -62.74 -31.16 72.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.491 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.0 mt -85.95 3.16 43.3 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -176.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.604 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 13.5 t70 -78.99 138.17 37.93 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.061 178.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.7 m -57.21 -38.07 73.17 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -176.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.5 ptp180 -68.6 -32.81 72.96 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.539 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 66.6 t -79.43 -31.16 14.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.261 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.604 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 86.9 mtt180 -61.82 -26.72 68.29 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.224 0.535 . . . . 0.0 109.646 173.048 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.431 ' HA ' ' NE ' ' A' ' 43' ' ' ARG . 6.8 tpm_? -85.71 -19.21 31.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.515 -178.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.1 p -82.6 155.18 68.67 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 122.057 -0.402 . . . . 0.0 110.688 178.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.411 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 35.3 Cg_endo -66.63 157.13 62.4 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.444 2.096 . . . . 0.0 111.777 175.261 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.404 ' O ' HG21 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -59.65 -34.98 73.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.88 -178.076 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.7 p -58.58 -43.5 89.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.229 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 71.1 m -65.24 -44.37 88.42 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.846 179.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.544 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 81.3 mttt -57.35 -49.64 75.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.123 -179.239 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.404 HG21 ' O ' ' A' ' 46' ' ' THR . 64.7 t -66.22 -42.52 91.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.005 -176.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 24.9 m170 -64.73 -42.63 95.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.159 -178.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -66.12 -41.74 90.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.412 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 81.2 mt -63.05 -40.68 98.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.869 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.5 tptt -60.92 -40.84 94.73 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.103 0.478 . . . . 0.0 110.015 175.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.0 t -67.46 -20.08 65.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.907 178.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -81.11 5.76 15.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.232 178.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.04 12.62 58.72 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.58 177.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.548 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.5 mp -83.34 170.11 14.92 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.523 0.678 . . . . 0.0 111.804 179.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.43 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 16.8 m -117.71 164.28 15.22 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.78 -1.1 . . . . 0.0 108.562 173.036 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.08 -35.93 72.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.732 0.301 . . . . 0.0 111.685 -175.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.1 mp0 -69.07 -37.27 78.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.054 0.454 . . . . 0.0 110.703 -177.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.43 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 1.5 mm-40 -68.44 -44.34 75.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.505 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 75.9 mt -62.5 -41.58 92.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.438 179.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 49.7 t -56.71 -42.99 80.14 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.99 178.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.684 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 26.9 tt0 -68.27 -48.4 65.13 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.52 179.311 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.0 -44.69 78.88 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.277 -177.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.51 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.2 m-85 -57.73 -42.81 84.63 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.902 0.382 . . . . 0.0 111.123 177.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.1 m -66.69 -33.12 74.93 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.331 0.586 . . . . 0.0 110.588 -178.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.684 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 25.2 mtpp -71.87 -31.95 66.96 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.471 -178.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.537 HG13 ' HB2' ' A' ' 36' ' ' LEU . 11.7 m -82.7 -3.91 7.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.813 0.339 . . . . 0.0 111.08 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 101.73 16.46 24.04 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.8 177.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -123.92 91.39 49.69 Favored Pre-proline 0 C--N 1.322 -0.622 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -71.43 101.61 1.16 Allowed 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 122.033 1.822 . . . . 0.0 112.115 -176.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -108.37 147.93 30.84 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.489 177.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 43.1 p -85.47 162.43 18.96 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.001 175.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.4 tp -63.64 -33.17 75.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.265 0.555 . . . . 0.0 109.714 177.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -61.83 -42.36 98.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.55 178.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.429 ' O ' HG13 ' A' ' 82' ' ' ILE . 24.5 mm-40 -56.03 -49.6 73.24 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.593 177.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.7 mm -62.72 -49.69 82.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.965 -174.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -64.14 -39.29 93.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.892 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 18.3 tpp180 -64.28 -45.14 89.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.94 178.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 78' ' ' GLU . 96.8 mt -63.15 -34.11 64.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.847 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.7 mt -77.0 -20.8 55.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.255 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 47.3 m . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.885 -0.578 . . . . 0.0 110.481 -179.033 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt . . . . . 0 CA--C 1.526 0.045 0 CA-C-O 120.411 0.148 . . . . 0.0 110.925 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.508 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 63.2 mtm180 -64.72 -48.37 74.87 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 120.922 0.392 . . . . 0.0 109.956 177.174 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.526 ' O ' HG21 ' A' ' 33' ' ' VAL . 86.0 t -60.7 -42.55 92.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.185 176.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.5 t -58.93 -45.9 89.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.028 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -61.26 -36.19 79.34 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.006 0.432 . . . . 0.0 110.668 178.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.32 -44.58 62.48 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.048 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.526 HG21 ' O ' ' A' ' 29' ' ' VAL . 92.7 t -60.96 -43.51 96.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.799 0.333 . . . . 0.0 110.536 -179.29 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -68.76 -34.5 75.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.982 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -72.94 -43.37 62.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.061 0.457 . . . . 0.0 110.711 178.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.514 ' HB2' HG12 ' A' ' 70' ' ' VAL . 84.2 mt -65.66 -29.44 70.0 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.602 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.4 HD21 ' HA ' ' A' ' 37' ' ' LEU . 15.5 mt -84.18 6.36 22.84 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.585 -177.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.496 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 22.9 t70 -83.57 136.76 34.13 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.874 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.1 t -53.8 -43.68 69.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.038 -177.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -68.55 -42.67 78.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.157 0.503 . . . . 0.0 110.396 -177.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.494 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 86.9 t -66.94 -34.54 70.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.034 -179.171 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 83.9 mtp180 -67.19 -22.94 65.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.247 177.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 57.8 ttp180 -84.3 -18.12 37.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.751 0.31 . . . . 0.0 110.936 -178.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -85.73 158.68 56.35 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.66 -0.246 . . . . 0.0 110.709 175.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.442 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 31.7 Cg_endo -65.43 157.04 60.21 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 122.671 2.247 . . . . 0.0 112.574 -179.472 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.443 ' O ' HG21 ' A' ' 50' ' ' VAL . 0.5 OUTLIER -60.37 -40.26 90.19 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.055 -177.411 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 11.0 m -58.12 -42.43 85.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.913 -177.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.414 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 56.4 m -62.75 -45.47 92.57 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.885 178.102 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.497 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 81.3 mttt -57.07 -49.37 76.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.996 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.443 HG21 ' O ' ' A' ' 46' ' ' THR . 99.6 t -64.77 -43.19 96.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.064 -176.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 29.0 m170 -64.45 -37.97 89.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.962 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.444 ' CE1' ' HE2' ' A' ' 56' ' ' LYS . 43.8 t80 -70.17 -42.77 72.02 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.514 -178.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 89.9 mt -64.0 -34.76 78.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.952 0.406 . . . . 0.0 110.801 178.558 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.437 ' HE3' ' HB3' ' A' ' 54' ' ' LYS . 0.5 OUTLIER -60.73 -43.5 97.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.336 175.199 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 45.8 m -69.79 -13.76 62.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.086 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.453 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 65.6 mttm -78.85 -8.18 58.58 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.315 174.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.4 20.72 28.99 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.047 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.508 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.7 mp -86.55 154.8 20.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.07 0.462 . . . . 0.0 111.254 178.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.493 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 13.1 m -93.84 161.87 14.15 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.19 174.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.24 -35.23 71.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.22 0.533 . . . . 0.0 110.875 -179.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -67.9 -38.89 83.54 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.527 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.493 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 4.2 mm-40 -65.89 -44.88 84.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.978 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 75.1 mt -62.04 -43.81 98.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.368 178.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 39.7 t -57.45 -44.17 84.54 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.753 176.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 70.1 tt0 -67.21 -47.28 71.33 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.838 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.45 -47.84 80.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.259 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.582 ' O ' HG21 ' A' ' 70' ' ' VAL . 6.2 m-85 -57.05 -44.54 83.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.988 0.423 . . . . 0.0 111.087 178.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.1 m -65.09 -32.77 74.64 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.996 0.427 . . . . 0.0 110.626 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 19.1 mtmt -71.27 -31.7 67.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.75 179.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.582 HG21 ' O ' ' A' ' 67' ' ' PHE . 11.0 m -82.29 -3.55 7.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-O 120.859 0.362 . . . . 0.0 111.439 -177.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 100.12 17.19 25.68 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.261 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -126.68 91.15 48.0 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 179.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -72.73 99.24 1.04 Allowed 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 121.706 1.604 . . . . 0.0 112.239 -176.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.42 ' HE3' HG21 ' A' ' 46' ' ' THR . 73.3 mmtt -107.59 137.37 45.74 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.193 175.447 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.429 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 76.7 p -80.69 159.41 25.29 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.398 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.416 ' O ' ' HG3' ' A' ' 80' ' ' LYS . 52.6 tp -61.42 -33.22 73.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.813 178.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -61.16 -43.58 98.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.917 178.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.429 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 21.6 mm-40 -59.13 -49.71 76.84 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.608 178.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 45.1 mm -62.66 -44.14 99.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.189 -174.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 76' ' ' LEU . 61.6 mttm -63.89 -38.62 91.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.807 0.337 . . . . 0.0 110.927 -179.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 18.3 tpt180 -67.73 -44.48 77.51 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.775 177.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 78' ' ' GLU . 90.7 mt -62.16 -37.82 79.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.874 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 81.4 mt -78.21 -25.85 47.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.551 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 C--O 1.252 1.191 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.691 -178.556 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 pttp . . . . . 0 N--CA 1.457 -0.108 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.451 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 39.8 mtm180 -66.05 -47.03 75.7 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.762 0.315 . . . . 0.0 110.523 179.233 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.505 ' O ' HG22 ' A' ' 33' ' ' VAL . 82.3 t -61.26 -42.68 94.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.215 177.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 35.8 m -58.69 -46.44 87.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.801 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -61.67 -36.0 79.58 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.083 0.468 . . . . 0.0 111.069 179.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.62 -44.41 62.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.006 179.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.505 HG22 ' O ' ' A' ' 29' ' ' VAL . 75.6 t -60.82 -43.24 95.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.845 0.355 . . . . 0.0 110.575 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -69.22 -34.04 74.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.019 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -72.43 -43.52 63.71 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.885 0.374 . . . . 0.0 110.775 178.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.52 ' HB2' HG12 ' A' ' 70' ' ' VAL . 88.9 mt -66.51 -31.45 72.19 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.702 -177.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.6 mt -85.98 6.83 26.88 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.83 0.347 . . . . 0.0 111.918 -177.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.483 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 14.3 t70 -77.58 135.88 38.21 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 176.212 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.7 m -57.8 -36.17 71.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.74 0.305 . . . . 0.0 111.698 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -69.21 -41.56 76.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.196 0.522 . . . . 0.0 110.612 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.482 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 88.8 t -72.37 -32.93 44.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.876 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 24.6 mtp180 -66.08 -21.62 66.38 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.577 175.422 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -80.99 -17.88 48.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.132 -177.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -92.02 158.72 39.13 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.132 178.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.408 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 32.8 Cg_endo -64.82 156.9 59.27 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.885 2.39 . . . . 0.0 112.347 178.318 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.437 HG21 ' HE3' ' A' ' 74' ' ' LYS . 1.1 m -65.7 -38.08 88.23 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.599 -174.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.3 m -58.69 -38.43 78.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.951 0.405 . . . . 0.0 110.731 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 75.5 m -65.88 -44.25 85.92 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.827 176.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.482 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 86.8 mttt -57.27 -47.74 80.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.546 178.322 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 46' ' ' THR . 82.3 t -63.87 -46.1 95.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.167 -177.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -64.16 -37.21 86.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.983 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -64.08 -47.23 80.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.463 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 96.2 mt -64.04 -37.07 86.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.942 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -59.29 -43.26 92.57 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.13 0.49 . . . . 0.0 110.436 176.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.4 m -70.52 -16.6 62.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.505 -179.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.4 mmtp -85.41 -4.32 59.12 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 120.781 0.324 . . . . 0.0 111.199 177.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.81 13.71 31.27 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.73 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.451 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.0 mp -87.31 149.88 24.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.189 0.518 . . . . 0.0 111.709 178.059 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.429 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 16.8 m -94.04 167.63 11.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.519 175.44 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.73 -38.16 80.92 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -177.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -65.89 -37.51 86.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.112 0.482 . . . . 0.0 110.406 -179.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.429 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 3.1 mm-40 -64.46 -47.45 78.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.682 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.76 -45.47 98.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.627 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 53.7 t -58.13 -44.71 87.95 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.168 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.629 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 29.9 tt0 -67.48 -48.32 67.48 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.663 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.65 -44.02 80.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.458 -178.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.564 ' O ' HG23 ' A' ' 70' ' ' VAL . 3.4 m-85 -58.53 -41.85 86.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.974 0.416 . . . . 0.0 111.207 179.057 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.8 m -65.77 -34.22 77.67 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.233 0.539 . . . . 0.0 110.422 -177.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.629 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 4.4 mtpm? -71.46 -31.2 66.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.957 179.249 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 67' ' ' PHE . 11.0 m -83.48 4.13 2.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.811 0.338 . . . . 0.0 111.23 -178.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 94.02 17.45 40.6 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.606 176.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -127.1 91.55 46.42 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -70.28 98.26 0.73 Allowed 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 121.748 1.632 . . . . 0.0 112.328 -177.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.437 ' HE3' HG21 ' A' ' 46' ' ' THR . 71.6 mmtt -106.61 140.19 39.87 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.799 177.653 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 30.6 p -86.06 156.57 20.35 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.26 178.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 37.5 tp -62.42 -32.3 73.12 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -56.81 -45.48 82.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.501 176.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.425 ' O ' HG13 ' A' ' 82' ' ' ILE . 33.0 mt-10 -61.79 -48.76 79.18 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.71 177.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 46.4 mm -60.29 -46.27 95.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.839 -176.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -63.02 -38.06 89.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.948 178.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.1 tpp180 -67.9 -44.15 77.64 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.697 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.425 HG13 ' O ' ' A' ' 78' ' ' GLU . 93.6 mt -64.67 -36.49 77.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.845 -179.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.7 mt -78.98 -25.27 43.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.328 178.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 C--O 1.252 1.203 0 CA-C-O 119.053 -0.499 . . . . 0.0 110.578 -176.903 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? . . . . . 0 N--CA 1.457 -0.107 0 CA-C-O 120.595 0.236 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.478 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 35.2 mtm180 -67.21 -44.5 79.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.402 177.444 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.609 ' O ' HG22 ' A' ' 33' ' ' VAL . 87.5 t -61.1 -46.84 95.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.156 177.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.1 m -62.4 -43.77 98.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.343 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -61.78 -36.04 79.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.124 0.488 . . . . 0.0 110.537 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.461 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -69.94 -43.89 70.69 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.584 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.609 HG22 ' O ' ' A' ' 29' ' ' VAL . 90.3 t -60.32 -46.23 95.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.011 0.434 . . . . 0.0 110.393 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.89 -33.7 74.2 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.26 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -72.1 -43.7 64.37 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.787 0.327 . . . . 0.0 110.789 177.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.529 ' HB2' HG11 ' A' ' 70' ' ' VAL . 95.1 mt -65.02 -31.3 72.46 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.213 -179.058 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.5 mt -85.84 5.84 30.9 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.991 -177.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.604 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 10.6 t70 -74.28 134.0 42.62 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 177.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 m -52.15 -36.7 52.24 Favored 'General case' 0 C--N 1.328 -0.365 0 O-C-N 123.386 0.428 . . . . 0.0 111.652 -176.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 84.5 mtm180 -68.86 -44.42 73.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.181 0.515 . . . . 0.0 110.978 178.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.52 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.3 t -70.96 -26.69 28.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.681 -176.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.604 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 52.1 mtt180 -62.39 -22.49 66.19 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.421 174.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -90.27 -18.4 25.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.73 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.1 p -81.57 152.71 70.21 Favored Pre-proline 0 C--N 1.326 -0.433 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.63 177.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.4 ' HG2' ' OG ' ' A' ' 48' ' ' SER . 26.4 Cg_endo -63.8 154.53 69.06 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.309 2.006 . . . . 0.0 111.912 177.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.411 ' O ' HG23 ' A' ' 50' ' ' VAL . 1.5 m -59.5 -39.54 84.16 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.249 -177.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.403 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 13.8 m -58.26 -42.26 86.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.843 -179.038 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.4 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 74.4 m -62.47 -44.27 96.81 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.152 178.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.52 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 84.7 mttt -57.65 -49.97 74.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.26 179.345 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 46' ' ' THR . 61.6 t -64.69 -40.96 90.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.113 -176.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 36.7 m170 -64.92 -38.37 90.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.903 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -64.68 -47.0 80.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.885 0.374 . . . . 0.0 110.359 179.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.473 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 90.1 mt -62.59 -37.68 87.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.134 -179.076 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.473 ' HD3' HD22 ' A' ' 83' ' ' LEU . 38.3 ttpt -60.74 -42.19 96.85 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.313 0.578 . . . . 0.0 110.029 175.048 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.6 t -63.19 -24.77 68.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.811 178.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -85.1 7.21 22.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.391 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.8 7.94 70.43 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.623 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.478 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.4 mp -75.85 147.74 38.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.349 0.595 . . . . 0.0 111.125 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.498 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 14.9 m -91.2 162.9 14.45 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.786 174.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.01 -35.93 71.95 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.99 0.424 . . . . 0.0 111.14 -177.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -63.91 -41.61 97.62 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.247 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.498 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 3.1 mm-40 -63.63 -45.63 89.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.422 0.63 . . . . 0.0 109.543 -178.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 63.2 mt -62.99 -43.65 99.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.709 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 40.3 t -56.59 -46.18 80.96 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.139 178.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -68.01 -47.68 67.79 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.698 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.404 ' O ' HG12 ' A' ' 70' ' ' VAL . . . -56.92 -46.31 82.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.902 -179.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.57 ' O ' HG22 ' A' ' 70' ' ' VAL . 2.6 m-85 -57.21 -45.72 83.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.247 179.316 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.9 m -65.25 -33.46 76.04 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.436 -177.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.439 ' HE3' HG21 ' A' ' 33' ' ' VAL . 25.9 mtmt -72.63 -27.04 61.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.996 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.57 HG22 ' O ' ' A' ' 67' ' ' PHE . 8.6 m -87.05 3.45 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-O 120.841 0.353 . . . . 0.0 111.217 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 94.56 15.77 45.4 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.571 -0.824 . . . . 0.0 112.623 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -124.17 91.58 49.39 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -71.71 99.79 0.99 Allowed 'Trans proline' 0 N--CA 1.455 -0.758 0 C-N-CA 121.997 1.798 . . . . 0.0 112.332 -176.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -113.12 140.94 47.47 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.922 176.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 33.2 p -82.93 167.91 17.54 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.596 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 60.5 tp -63.0 -33.86 76.32 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 174.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -62.23 -43.63 98.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.458 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -57.06 -48.58 78.22 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.818 178.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.9 mm -61.33 -48.88 86.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.825 -176.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -64.64 -35.38 80.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.846 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.8 tpt180 -61.98 -45.77 92.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.247 0.546 . . . . 0.0 110.348 175.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.403 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 78.4 mt -68.1 -33.96 63.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.172 -178.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.473 HD22 ' HD3' ' A' ' 54' ' ' LYS . 87.5 mt -81.79 -20.68 38.66 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.906 178.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 71.5 m . . . . . 0 C--O 1.252 1.223 0 CA-C-O 117.963 -1.018 . . . . 0.0 111.684 179.236 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt . . . . . 0 CA--C 1.527 0.077 0 CA-C-O 120.54 0.209 . . . . 0.0 110.546 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.5 mtm-85 -68.45 -41.24 80.55 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.567 ' O ' HG21 ' A' ' 33' ' ' VAL . 69.2 t -60.91 -44.87 98.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.303 -0.408 . . . . 0.0 109.994 174.308 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.1 m -58.77 -42.2 88.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.021 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.489 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 23.3 m-80 -66.48 -34.76 78.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.051 0.453 . . . . 0.0 110.994 177.153 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.59 -43.99 65.27 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.108 177.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.567 HG21 ' O ' ' A' ' 29' ' ' VAL . 94.4 t -61.25 -40.93 87.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.847 0.356 . . . . 0.0 110.752 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.489 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 12.3 pt-20 -68.94 -37.49 78.91 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.563 178.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -72.28 -43.53 64.12 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.161 -179.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.546 ' HB2' HG13 ' A' ' 70' ' ' VAL . 74.0 mt -65.1 -31.68 73.0 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.45 -179.165 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.3 mt -85.79 6.48 27.79 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -176.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -76.87 139.05 40.13 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 177.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.9 t -59.45 -31.78 69.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.85 0.357 . . . . 0.0 111.057 -178.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -68.53 -42.69 78.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.372 0.606 . . . . 0.0 110.549 178.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 93.6 t -79.52 -32.26 14.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.271 -171.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -67.92 -22.2 65.08 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.118 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -83.98 -18.09 38.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.72 0.295 . . . . 0.0 111.496 -178.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.09 162.93 50.35 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 116.638 -0.256 . . . . 0.0 110.756 177.231 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -63.97 157.9 50.33 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.626 2.217 . . . . 0.0 112.376 179.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.69 -35.18 78.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.075 -178.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.546 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 14.6 p -58.73 -43.66 90.26 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.402 -178.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.3 m -61.12 -45.93 92.68 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.965 178.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.454 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 82.0 mttt -57.34 -50.3 73.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.564 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 92.1 t -65.57 -44.91 93.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.201 -174.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 27.3 m170 -64.48 -35.99 82.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.005 -177.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -70.19 -38.53 75.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.277 -178.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 82.5 mt -69.83 -37.62 76.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.699 178.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -62.56 -38.26 89.34 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.162 0.506 . . . . 0.0 109.851 174.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.5 t -67.1 -19.96 65.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.441 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 69.0 mmtt -80.81 -8.37 59.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.768 177.232 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.07 15.67 38.08 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.601 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.9 mp -80.94 145.56 31.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.104 0.478 . . . . 0.0 111.402 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.2 m -82.28 163.46 21.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.539 173.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.73 -41.1 85.63 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.843 0.354 . . . . 0.0 111.246 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -70.55 -30.37 67.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.393 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -66.97 -45.73 76.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.225 0.535 . . . . 0.0 109.941 175.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 64.7 mt -62.67 -43.09 98.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.232 177.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 43.9 t -56.76 -43.62 80.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.836 176.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.98 -48.56 65.46 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.824 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.1 -42.62 81.09 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.281 -179.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.463 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.3 m-85 -60.8 -47.57 85.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.917 177.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 21.8 m -64.07 -34.96 79.21 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.04 0.448 . . . . 0.0 110.255 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mmmt -62.79 -35.39 79.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.602 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.546 HG13 ' HB2' ' A' ' 36' ' ' LEU . 22.4 m -87.42 7.23 2.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -176.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.6 18.39 48.64 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.657 177.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -123.75 90.97 50.18 Favored Pre-proline 0 C--N 1.322 -0.613 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 177.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -71.92 97.71 0.84 Allowed 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 121.903 1.736 . . . . 0.0 112.437 -176.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -106.97 137.96 44.06 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.848 176.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.7 p -80.64 162.05 24.4 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.409 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 64.7 tp -61.42 -33.61 74.0 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 175.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -60.18 -44.32 95.14 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.365 176.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.444 ' O ' HG13 ' A' ' 82' ' ' ILE . 8.7 mm-40 -61.21 -47.3 86.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.125 177.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.8 mm -60.13 -47.44 91.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.888 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -62.42 -40.85 97.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.13 0.491 . . . . 0.0 110.548 177.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -59.89 -47.02 87.45 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.747 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.546 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 88.8 mt -66.72 -31.64 54.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.09 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.1 mt -77.73 -12.57 59.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.204 178.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 25.9 p . . . . . 0 C--O 1.252 1.187 0 CA-C-O 119.036 -0.507 . . . . 0.0 110.577 177.305 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt . . . . . 0 N--CA 1.456 -0.155 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.447 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 34.8 mtm180 -63.19 -46.31 87.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 0.0 110.506 178.149 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.574 ' O ' HG23 ' A' ' 33' ' ' VAL . 97.9 t -61.74 -46.76 95.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.589 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.1 p -62.0 -38.51 88.88 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.247 -0.181 . . . . 0.0 111.428 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -61.15 -41.14 96.21 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.23 0.538 . . . . 0.0 110.37 176.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.69 -44.84 63.52 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.117 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 29' ' ' VAL . 87.0 t -61.49 -42.14 92.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.745 -179.225 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -69.23 -36.13 76.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.644 0.259 . . . . 0.0 110.829 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -71.97 -43.8 64.58 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.875 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.53 ' HB2' HG12 ' A' ' 70' ' ' VAL . 86.9 mt -65.74 -29.98 70.57 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.538 -178.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.435 ' HG ' ' CG1' ' A' ' 70' ' ' VAL . 12.2 mt -85.13 6.32 26.11 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -176.204 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.497 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 25.6 t70 -79.51 138.71 37.62 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.348 177.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.427 ' O ' ' HG2' ' A' ' 43' ' ' ARG . 23.1 m -57.04 -41.57 78.87 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -176.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.9 mmp_? -68.71 -38.55 80.34 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.087 0.47 . . . . 0.0 110.206 179.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.9 t -71.64 -25.15 24.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.387 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 71.0 mtp180 -72.75 -20.53 61.17 Favored 'General case' 0 C--N 1.319 -0.738 0 O-C-N 122.051 -0.406 . . . . 0.0 110.895 172.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.427 ' HG2' ' O ' ' A' ' 39' ' ' SER . 32.4 mmm180 -96.18 10.73 36.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.738 -177.596 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.487 ' C ' ' HZ3' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -110.12 168.08 8.15 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.677 178.249 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.41 ' HD2' HG22 ' A' ' 44' ' ' THR . 57.9 Cg_endo -70.73 156.26 61.14 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.425 2.083 . . . . 0.0 111.71 175.332 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.412 HG22 ' HE3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -67.21 -34.01 76.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.898 0.38 . . . . 0.0 111.067 -177.138 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.478 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 11.5 p -58.39 -42.16 86.49 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.513 -176.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.9 m -61.6 -42.33 98.71 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.877 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.487 ' HZ3' ' C ' ' A' ' 44' ' ' THR . 21.1 mttm -63.97 -47.41 80.5 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.654 -178.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 68.5 t -63.82 -44.41 98.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.743 -175.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -65.11 -40.52 94.64 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.743 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -62.53 -47.36 84.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.586 178.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 89.9 mt -64.58 -36.47 84.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.982 -178.624 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -64.3 -38.12 89.91 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 120.929 0.395 . . . . 0.0 110.241 176.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.2 t -66.68 -25.19 66.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.058 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.7 mmtt -78.12 -4.29 46.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.078 178.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.8 8.46 54.26 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.457 178.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.447 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.8 mp -80.43 146.62 31.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.454 0.645 . . . . 0.0 111.333 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.3 m -89.41 165.74 14.16 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.328 175.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.0 -37.27 76.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.962 0.41 . . . . 0.0 110.958 -178.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -64.13 -42.5 96.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.708 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -64.11 -44.81 91.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.38 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 77.2 mt -61.51 -42.89 95.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.299 178.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 43.5 t -57.88 -46.0 85.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.967 177.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -68.11 -45.11 74.6 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.247 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.44 -41.74 81.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.61 0.243 . . . . 0.0 111.207 -178.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.468 ' O ' HG22 ' A' ' 70' ' ' VAL . 8.9 m-85 -61.48 -46.33 90.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.052 0.453 . . . . 0.0 110.595 176.247 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 20.2 m -63.25 -32.84 74.35 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.089 0.471 . . . . 0.0 110.402 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 12.7 mmmt -66.74 -33.37 75.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.882 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.53 HG12 ' HB2' ' A' ' 36' ' ' LEU . 22.0 m -87.22 -0.17 7.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.729 0.299 . . . . 0.0 111.632 -177.428 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 99.27 16.29 30.29 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.579 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -122.86 91.43 49.73 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 178.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -70.84 100.57 0.96 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 121.786 1.657 . . . . 0.0 112.125 -177.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.412 ' HE3' HG22 ' A' ' 46' ' ' THR . 67.5 mmtt -105.22 142.6 34.71 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.679 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 41.6 p -83.12 156.01 23.51 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.289 178.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.87 -32.56 73.83 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 177.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.5 t30 -58.28 -45.78 87.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.748 177.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -59.3 -46.68 87.91 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.189 179.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 41.6 mm -60.3 -45.47 96.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.524 -177.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -64.29 -39.85 94.77 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.015 0.436 . . . . 0.0 110.858 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 64.5 ttt180 -60.11 -46.56 89.21 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.548 177.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.478 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 89.8 mt -67.35 -31.94 55.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.305 -0.862 . . . . 0.0 111.298 -179.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.4 mt -83.14 -14.25 53.95 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.332 179.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 21.8 p . . . . . 0 C--O 1.25 1.103 0 C-N-CA 123.653 0.781 . . . . 0.0 111.76 -179.242 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.9 pttm . . . . . 0 N--CA 1.454 -0.238 0 CA-C-O 120.325 0.107 . . . . 0.0 110.953 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.425 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 25.0 mtm180 -67.64 -48.1 67.69 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.772 0.32 . . . . 0.0 110.398 178.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.572 ' O ' HG23 ' A' ' 33' ' ' VAL . 98.3 t -60.94 -39.95 83.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.821 176.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.8 t -58.37 -45.45 88.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.502 178.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.418 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 93.3 m-20 -62.59 -37.74 87.43 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.733 178.564 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.66 -45.04 63.17 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.414 -179.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' ' 29' ' ' VAL . 93.1 t -61.16 -41.91 91.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.87 0.367 . . . . 0.0 110.654 -178.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 10.4 pt-20 -68.93 -37.5 78.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.713 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -71.6 -43.01 67.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.936 0.398 . . . . 0.0 110.841 -179.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.52 ' HB2' HG13 ' A' ' 70' ' ' VAL . 84.0 mt -65.01 -30.39 71.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.577 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.3 mt -85.18 7.03 23.32 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -176.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.496 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 11.3 t70 -80.12 135.95 36.42 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 176.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.454 ' O ' ' HG3' ' A' ' 43' ' ' ARG . 15.4 p -57.12 -36.95 71.27 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.871 0.367 . . . . 0.0 111.48 -176.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 80.7 mtm180 -68.58 -38.96 81.11 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.273 0.559 . . . . 0.0 110.262 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 57.9 t -78.5 -25.03 13.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.228 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 79.7 mtp180 -72.69 -33.12 66.27 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.72 -0.392 . . . . 0.0 112.043 178.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.454 ' HG3' ' O ' ' A' ' 39' ' ' SER . 77.1 mtp180 -81.32 -10.25 59.6 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -173.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.482 ' C ' ' HZ1' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -79.41 173.54 7.56 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.76 -0.2 . . . . 0.0 110.632 177.087 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.437 ' HD2' HG21 ' A' ' 44' ' ' THR . 46.4 Cg_endo -68.62 155.65 68.19 Favored 'Trans proline' 0 C--O 1.239 0.54 0 C-N-CA 121.941 1.761 . . . . 0.0 111.249 171.003 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.37 -33.69 74.72 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.812 0.339 . . . . 0.0 111.019 -177.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.447 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 15.4 p -57.78 -42.64 84.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.259 -176.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.1 m -62.1 -43.82 97.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.111 -179.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.482 ' HZ1' ' C ' ' A' ' 44' ' ' THR . 17.2 mttm -62.05 -47.43 84.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.476 -177.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 76.6 t -64.53 -43.52 96.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.73 -177.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 37.8 m170 -64.87 -37.71 88.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.504 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -63.86 -51.24 65.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.436 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.407 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 91.6 mt -62.24 -36.28 81.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.063 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.19 -43.42 95.92 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.23 0.538 . . . . 0.0 110.309 176.566 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.2 t -70.68 -14.21 62.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.238 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -86.73 0.75 54.11 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.843 0.354 . . . . 0.0 110.925 177.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.65 10.32 50.49 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.475 177.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.425 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.8 mp -88.56 148.02 24.31 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.372 0.606 . . . . 0.0 111.119 178.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.405 ' O ' HG13 ' A' ' 63' ' ' ILE . 50.9 m -95.28 173.13 7.7 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.942 -1.027 . . . . 0.0 109.771 176.085 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.83 87.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.924 0.392 . . . . 0.0 111.313 -177.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -67.58 -35.51 79.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.261 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -64.17 -45.98 86.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.459 0.647 . . . . 0.0 109.51 178.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 59' ' ' SER . 64.4 mt -65.19 -43.65 95.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.816 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 53.2 t -57.36 -43.22 83.32 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.915 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.47 -48.62 66.65 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.762 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.2 -47.62 80.81 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.198 -178.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.544 ' O ' HG22 ' A' ' 70' ' ' VAL . 5.1 m-85 -56.93 -45.83 82.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.278 179.115 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.6 m -64.91 -33.14 75.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.965 0.412 . . . . 0.0 110.584 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.1 mtmt -70.56 -31.62 68.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.973 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.544 HG22 ' O ' ' A' ' 67' ' ' PHE . 14.3 m -83.68 -3.78 7.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.836 0.35 . . . . 0.0 111.457 -176.75 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 101.14 18.49 19.48 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.339 178.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -126.87 91.39 47.21 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 177.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -72.87 101.72 1.35 Allowed 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 121.711 1.608 . . . . 0.0 112.281 -176.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -111.26 140.51 45.76 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.64 175.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 47.3 p -81.92 165.52 20.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.956 0.408 . . . . 0.0 110.474 177.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.4 -33.02 74.64 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.784 177.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -63.49 -42.15 98.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.076 178.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.509 ' O ' HG13 ' A' ' 82' ' ' ILE . 2.7 mm-40 -58.14 -48.19 81.01 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.829 177.002 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 42.3 mm -62.69 -42.11 94.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.468 -178.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -61.96 -43.69 98.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.974 0.416 . . . . 0.0 110.572 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 27.2 tpt180 -60.67 -45.89 92.43 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.353 -0.839 . . . . 0.0 111.078 178.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.509 HG13 ' O ' ' A' ' 78' ' ' GLU . 82.8 mt -67.91 -35.6 72.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.102 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 71.5 mt -77.8 -13.4 59.9 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 -179.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 20.8 p . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.474 -0.774 . . . . 0.0 109.975 175.675 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? . . . . . 0 N--CA 1.455 -0.18 0 CA-C-O 120.333 0.111 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.43 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 28.2 mtm180 -66.51 -41.11 89.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.502 0.191 . . . . 0.0 110.772 178.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.418 ' O ' HG21 ' A' ' 33' ' ' VAL . 70.6 t -63.09 -41.96 94.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 175.491 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.4 m -58.6 -46.96 85.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.262 176.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -62.37 -38.41 89.46 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.142 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.431 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -70.43 -45.34 66.05 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.168 -177.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.418 HG21 ' O ' ' A' ' 29' ' ' VAL . 71.3 t -61.5 -44.68 98.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.877 0.37 . . . . 0.0 110.454 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -69.43 -33.66 73.29 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.924 -179.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -71.4 -43.07 67.51 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.953 0.406 . . . . 0.0 110.388 179.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.535 ' HB2' HG13 ' A' ' 70' ' ' VAL . 90.4 mt -64.27 -29.22 70.32 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.27 178.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.4 mt -85.35 6.5 26.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.168 -0.469 . . . . 0.0 112.084 -178.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -82.13 139.0 34.62 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.214 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.481 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 25.1 t -58.21 -37.4 74.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.628 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -68.18 -37.03 80.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.16 0.505 . . . . 0.0 110.438 -179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.56 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.0 t -79.33 -34.21 16.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.34 -176.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.481 ' HG2' ' O ' ' A' ' 39' ' ' SER . 39.6 ptt180 -68.26 -22.21 64.77 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.79 0.329 . . . . 0.0 110.543 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.2 ttp180 -84.75 -19.22 33.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.867 -178.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.22 161.35 49.44 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.92 178.336 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.402 ' HG2' ' OG ' ' A' ' 48' ' ' SER . 32.6 Cg_endo -63.53 155.99 59.43 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.687 2.258 . . . . 0.0 112.264 177.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.69 -38.28 87.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.291 -177.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.8 m -58.76 -41.13 85.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.01 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.402 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 62.2 m -61.77 -45.99 91.51 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.801 178.393 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.56 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 80.1 mttt -56.91 -49.18 76.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.241 178.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 84.5 t -63.23 -45.28 98.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.143 -177.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 39.8 m170 -64.83 -37.24 86.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.964 -178.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -66.71 -45.99 76.98 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.691 0.281 . . . . 0.0 110.349 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 88.1 mt -62.23 -37.4 85.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.69 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.2 tppt? -59.79 -42.55 93.62 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.152 174.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.6 m -67.51 -15.32 63.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.973 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 27.6 mmtp -86.77 -4.6 59.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.901 177.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.15 7.68 55.93 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.858 -0.686 . . . . 0.0 112.753 178.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.43 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 5.1 mp -73.13 150.4 42.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.368 0.604 . . . . 0.0 111.602 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.6 m -90.88 161.28 15.29 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.362 -0.835 . . . . 0.0 108.78 173.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.27 -38.71 77.51 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.989 0.424 . . . . 0.0 110.498 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.406 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 1.8 mp0 -59.64 -43.16 93.95 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.716 177.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.11 -43.66 77.9 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.77 -178.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 74.7 mt -60.78 -44.34 97.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.079 176.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 52.9 t -59.37 -43.94 92.8 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.721 178.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.695 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 30.3 tt0 -67.53 -48.99 65.43 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.879 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.65 -45.24 81.74 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 120.54 0.21 . . . . 0.0 111.047 -178.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.546 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.7 m-85 -57.04 -44.95 83.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.927 0.394 . . . . 0.0 111.055 177.448 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.8 m -65.14 -33.14 75.32 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.251 0.548 . . . . 0.0 110.485 -177.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.695 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 20.7 mtpp -71.65 -32.34 67.82 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.797 -179.21 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.546 HG22 ' O ' ' A' ' 67' ' ' PHE . 15.2 m -81.9 -4.41 7.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 121.049 -0.261 . . . . 0.0 111.314 -177.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 102.04 16.66 22.84 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.407 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.413 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 5.6 tp-100 -126.79 90.93 48.43 Favored Pre-proline 0 C--N 1.323 -0.587 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -74.02 99.43 1.17 Allowed 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 121.974 1.783 . . . . 0.0 112.268 -176.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -106.46 138.08 43.29 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.557 175.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.414 ' O ' HG12 ' A' ' 79' ' ' ILE . 63.7 p -77.32 156.31 31.41 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.26 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 37.8 tp -62.94 -32.69 74.06 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -60.79 -46.08 91.88 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.626 175.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -60.44 -43.76 96.48 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.383 178.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 75' ' ' THR . 45.7 mm -60.35 -43.25 93.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.533 0.206 . . . . 0.0 110.684 -178.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -63.98 -41.35 97.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.295 0.569 . . . . 0.0 110.649 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -59.8 -42.45 93.44 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.825 177.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 79.8 mt -73.91 -32.69 34.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.288 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 64.3 mt -80.92 -1.97 45.7 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.248 1.011 0 CA-C-O 119.144 -0.455 . . . . 0.0 110.485 175.857 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.0 pttt . . . . . 0 N--CA 1.45 -0.447 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.5 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 31.9 mtm180 -65.9 -44.22 85.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.746 -0.206 . . . . 0.0 110.65 177.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.565 ' O ' HG22 ' A' ' 33' ' ' VAL . 94.5 t -60.75 -44.56 97.6 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.159 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 174.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 29.6 m -58.71 -44.17 90.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.749 178.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -62.77 -37.07 85.17 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.169 0.509 . . . . 0.0 110.763 177.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.03 -44.41 63.44 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.914 -178.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 29' ' ' VAL . 92.9 t -61.38 -42.9 95.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.458 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.5 -36.79 76.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.662 0.268 . . . . 0.0 110.938 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -71.48 -42.95 67.43 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.945 0.402 . . . . 0.0 110.636 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.508 ' HB2' HG13 ' A' ' 70' ' ' VAL . 80.6 mt -66.97 -30.75 70.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.196 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.412 ' HG ' ' CG1' ' A' ' 70' ' ' VAL . 12.6 mt -85.38 7.49 22.3 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.628 -178.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -81.16 137.98 35.89 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.058 175.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.421 ' HA ' ' HG2' ' A' ' 42' ' ' ARG . 15.8 m -61.53 -36.45 80.61 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.773 -176.366 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -70.33 -39.38 74.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.225 0.535 . . . . 0.0 109.66 -179.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.469 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 91.3 t -76.36 -36.78 30.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.603 -177.589 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.421 ' HG2' ' HA ' ' A' ' 39' ' ' SER . 40.2 ptt180 -65.91 -20.18 66.13 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 121.937 -0.477 . . . . 0.0 109.792 176.685 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 28.2 tpt180 -83.07 -19.03 37.61 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.545 179.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 p -82.4 161.18 60.31 Favored Pre-proline 0 C--N 1.33 -0.241 0 O-C-N 122.144 -0.347 . . . . 0.0 111.081 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -59.94 149.74 82.23 Favored 'Trans proline' 0 C--O 1.237 0.428 0 C-N-CA 122.641 2.227 . . . . 0.0 112.032 176.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.88 -36.39 76.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.247 -177.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.7 p -58.56 -42.61 88.34 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.121 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 52.0 m -62.06 -45.86 91.67 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.065 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.493 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 82.3 mttt -57.09 -49.91 74.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.326 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 81.3 t -63.58 -44.88 98.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.012 -177.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -64.83 -38.69 91.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.306 -177.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -64.63 -47.89 76.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.667 0.27 . . . . 0.0 110.469 178.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 86.1 mt -62.23 -41.05 98.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.203 -178.463 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.0 tptt -61.57 -42.27 98.6 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 120.923 0.392 . . . . 0.0 110.266 177.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.9 m -67.45 -17.33 64.66 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.106 179.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.18 -3.59 52.7 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.882 0.372 . . . . 0.0 110.982 177.018 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.24 8.34 47.41 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.922 176.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.5 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.4 mp -75.11 157.15 35.18 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.631 0.729 . . . . 0.0 111.821 -179.118 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.8 m -95.05 160.69 14.45 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.947 172.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.67 -37.69 76.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.897 0.379 . . . . 0.0 111.386 -177.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -70.66 -29.49 65.85 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.438 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -71.37 -44.36 65.16 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.073 0.463 . . . . 0.0 110.233 177.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 60.0 mt -62.49 -42.1 94.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.048 176.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 48.3 t -56.77 -46.29 81.55 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.267 -0.878 . . . . 0.0 110.963 178.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -66.59 -47.53 72.42 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.666 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.24 -42.07 80.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.595 -176.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -61.45 -44.96 96.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.088 0.47 . . . . 0.0 110.78 176.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.1 m -64.71 -33.63 76.42 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.202 0.525 . . . . 0.0 110.297 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.7 mmmt -62.98 -36.56 83.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.38 178.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.508 HG13 ' HB2' ' A' ' 36' ' ' LEU . 19.7 m -89.61 3.69 6.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -174.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.06 18.42 29.29 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.275 -0.964 . . . . 0.0 112.9 177.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -126.77 90.83 48.69 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -71.6 100.34 1.03 Allowed 'Trans proline' 0 N--CA 1.461 -0.4 0 C-N-CA 121.955 1.77 . . . . 0.0 112.816 -175.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -108.33 146.38 33.05 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.989 176.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 39.1 p -89.37 165.84 14.11 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.593 177.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 61.0 tp -63.32 -35.19 79.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.277 0.56 . . . . 0.0 109.599 174.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.95 -40.5 96.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.594 178.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.481 ' O ' HG13 ' A' ' 82' ' ' ILE . 12.5 mm-40 -56.92 -49.27 76.12 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.592 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.5 mm -63.02 -45.44 98.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.742 -176.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -57.63 -42.53 83.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.145 0.497 . . . . 0.0 111.177 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -66.4 -48.02 71.43 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.771 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 78' ' ' GLU . 86.5 mt -62.25 -36.19 73.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.289 -178.102 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.7 mt -78.09 -25.79 47.76 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.078 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 69.9 m . . . . . 0 C--O 1.249 1.054 0 O-C-N 123.84 0.712 . . . . 0.0 112.288 179.47 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? . . . . . 0 C--O 1.226 -0.174 0 N-CA-C 110.843 -0.058 . . . . 0.0 110.843 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.435 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 20.6 mtm180 -58.88 -48.97 79.5 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 120.893 0.378 . . . . 0.0 110.6 177.485 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.552 ' O ' HG22 ' A' ' 33' ' ' VAL . 99.2 t -63.12 -45.15 99.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.192 177.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.1 t -58.58 -45.23 89.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.728 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -62.12 -38.72 89.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.072 0.463 . . . . 0.0 110.768 179.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.23 -43.89 63.71 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.066 179.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.552 HG22 ' O ' ' A' ' 29' ' ' VAL . 69.2 t -60.95 -43.18 95.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.553 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -69.65 -35.45 75.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.724 0.297 . . . . 0.0 111.062 179.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -72.6 -43.13 63.74 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 120.991 0.424 . . . . 0.0 110.908 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.524 ' HB2' HG13 ' A' ' 70' ' ' VAL . 91.5 mt -65.71 -30.41 71.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.847 179.319 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.6 mt -85.82 7.15 25.0 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.526 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -78.76 138.87 38.43 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.835 0.35 . . . . 0.0 110.627 -178.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.592 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 14.9 t -57.87 -35.21 70.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.329 -178.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -69.87 -38.84 76.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.148 0.499 . . . . 0.0 110.984 178.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.6 t -79.39 -27.91 13.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.739 -174.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.592 ' HG2' ' O ' ' A' ' 39' ' ' SER . 39.0 ptt180 -64.13 -21.84 66.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.953 0.406 . . . . 0.0 110.735 178.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -88.27 -17.54 30.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.032 -179.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.8 p -86.01 157.04 57.51 Favored Pre-proline 0 C--N 1.326 -0.43 0 C-N-CA 121.055 -0.258 . . . . 0.0 111.089 179.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.412 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 35.7 Cg_endo -64.88 159.81 44.17 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.718 2.278 . . . . 0.0 112.149 177.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.434 HG22 ' HE3' ' A' ' 74' ' ' LYS . 1.3 m -59.8 -41.53 91.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.024 -178.222 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.452 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 10.1 m -58.65 -40.56 83.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.34 -176.142 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.6 m -63.57 -42.38 98.33 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 120.719 0.295 . . . . 0.0 110.999 177.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.412 ' HG3' ' O ' ' A' ' 45' ' ' PRO . 80.8 mttt -59.79 -48.32 82.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.124 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 58.5 t -65.84 -43.22 93.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.887 -177.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 37.1 m170 -62.84 -39.61 94.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.598 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -64.24 -51.08 65.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.554 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.4 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 94.9 mt -60.55 -38.69 85.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.969 -178.02 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.37 -44.18 97.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.165 0.507 . . . . 0.0 110.152 176.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 18.5 m -64.77 -19.34 65.76 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.445 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -85.22 -1.37 56.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.275 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 96.01 12.71 51.82 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.619 177.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.435 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.6 mp -81.57 152.63 27.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.051 0.453 . . . . 0.0 111.033 177.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.511 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 17.8 m -95.6 163.97 12.98 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.422 176.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.18 -37.57 75.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.889 0.376 . . . . 0.0 111.349 -177.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -65.01 -40.76 95.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.485 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.511 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 4.6 mm-40 -64.28 -45.1 89.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.309 0.576 . . . . 0.0 109.514 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 76.6 mt -63.03 -45.48 98.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.9 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 48.2 t -56.81 -45.29 82.35 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.298 -179.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -68.13 -47.36 68.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.806 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.13 -41.78 79.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.486 -179.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -59.32 -47.97 83.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.946 177.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.0 m -63.98 -32.63 74.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.23 0.538 . . . . 0.0 110.322 -179.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mmmt -65.51 -33.99 77.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.065 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.524 HG13 ' HB2' ' A' ' 36' ' ' LEU . 26.0 m -89.14 5.78 4.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.742 0.306 . . . . 0.0 111.701 -177.256 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.78 22.37 33.73 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.532 -0.842 . . . . 0.0 112.326 178.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -127.36 91.03 47.22 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 175.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -70.1 104.45 1.37 Allowed 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 121.788 1.659 . . . . 0.0 112.168 -177.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.434 ' HE3' HG22 ' A' ' 46' ' ' THR . 72.5 mmtt -115.12 137.52 51.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.318 176.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 73.9 p -81.76 162.3 22.97 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 178.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 55.1 tp -62.39 -33.14 74.18 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.417 0.627 . . . . 0.0 109.41 177.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -61.9 -45.2 94.75 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.553 177.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -59.41 -47.0 87.14 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.038 179.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 43.5 mm -59.53 -46.21 93.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.563 -177.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -64.48 -38.43 90.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.027 0.441 . . . . 0.0 111.192 178.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -66.03 -41.41 90.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.822 178.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.452 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 81.1 mt -67.1 -32.22 56.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.23 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 98.7 mt -78.13 -20.82 51.35 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.051 178.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 12.4 m . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.593 -177.567 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 33.4 pttt . . . . . 0 N--CA 1.481 1.091 0 N-CA-C 110.689 -0.115 . . . . 0.0 110.689 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.08 117.37 5.12 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.27 1.98 . . . . 0.0 110.714 171.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -84.34 93.74 8.31 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.347 0.594 . . . . 0.0 109.805 -175.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 44.6 t -94.38 -35.55 6.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.713 -177.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -128.9 -170.45 2.27 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.813 178.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 39.5 m80 -100.3 164.04 12.12 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.0 m -59.98 98.53 0.06 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.904 0.383 . . . . 0.0 110.948 -178.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -71.12 -24.48 62.29 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.091 -174.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 28.5 m -65.68 -33.69 76.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.969 0.414 . . . . 0.0 110.032 176.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.519 ' O ' ' HG2' ' A' ' 27' ' ' LYS . 38.7 tt0 -71.5 -41.46 69.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.957 179.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -66.27 -46.9 75.43 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.313 175.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -57.34 -40.98 79.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.539 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 17.2 pttp -72.19 -32.21 66.61 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 121.043 -0.263 . . . . 0.0 111.013 -178.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.473 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 82.8 mtm-85 -67.8 -44.06 78.23 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 176.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.534 ' O ' HG22 ' A' ' 33' ' ' VAL . 87.6 t -61.41 -38.5 80.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.745 175.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.2 t -58.32 -45.66 87.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.413 177.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -61.87 -36.6 81.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.22 178.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.39 -45.25 55.88 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.235 -179.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.534 HG22 ' O ' ' A' ' 29' ' ' VAL . 94.7 t -62.4 -40.0 86.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.764 -178.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -68.92 -38.75 79.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.796 0.331 . . . . 0.0 110.753 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -71.74 -42.6 67.06 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.745 -178.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.534 ' HB2' HG11 ' A' ' 70' ' ' VAL . 89.8 mt -67.28 -30.92 70.93 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.155 179.448 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.6 mt -85.32 6.04 28.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.565 -179.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.626 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 12.2 t70 -73.94 128.91 36.77 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -53.52 -44.0 68.78 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -175.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 86.1 mtm180 -69.11 -33.59 73.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.292 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.525 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 98.5 t -73.59 -28.68 25.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.159 0.504 . . . . 0.0 110.419 178.022 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.626 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 90.9 mtt180 -62.43 -22.26 66.05 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.042 0.449 . . . . 0.0 110.322 173.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 34.9 ttm180 -93.46 -17.07 23.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.332 -177.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.6 p -80.31 158.32 71.91 Favored Pre-proline 0 C--N 1.33 -0.277 0 O-C-N 122.269 -0.269 . . . . 0.0 110.654 174.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.401 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 36.9 Cg_endo -67.05 156.3 66.95 Favored 'Trans proline' 0 C--O 1.234 0.324 0 C-N-CA 122.595 2.196 . . . . 0.0 112.234 178.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.49 ' O ' HG21 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -59.66 -37.91 80.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.924 -177.996 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.6 p -58.42 -42.77 87.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.466 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.9 m -63.97 -42.68 97.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.118 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.525 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 78.4 mttt -60.88 -49.45 77.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.284 178.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.49 HG21 ' O ' ' A' ' 46' ' ' THR . 63.7 t -65.18 -44.62 95.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.187 -174.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 15.7 m170 -63.31 -37.83 88.79 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.217 -177.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -70.57 -45.57 65.15 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.897 -178.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 91.8 mt -61.99 -40.19 94.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.049 -178.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.479 ' HD2' ' C ' ' A' ' 54' ' ' LYS . 0.9 OUTLIER -59.77 -43.7 94.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.323 0.583 . . . . 0.0 109.888 177.521 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.4 m -68.7 -14.36 62.97 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.396 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 35.5 mtpt -87.58 3.67 46.67 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.949 177.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.72 2.4 52.76 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.994 174.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.473 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.8 mp -78.24 154.66 30.83 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.372 0.606 . . . . 0.0 111.663 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.402 ' O ' HG13 ' A' ' 63' ' ' ILE . 16.2 m -95.9 161.22 14.09 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.309 173.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.9 -38.66 76.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.855 0.359 . . . . 0.0 111.284 -177.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.02 -37.42 87.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.988 178.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -71.53 -39.26 70.85 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.386 -179.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 59' ' ' SER . 80.6 mt -63.16 -43.96 99.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.189 176.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 40.7 t -56.71 -42.19 78.73 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.913 177.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -68.18 -48.54 64.99 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.917 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.21 -41.91 80.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.403 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -58.81 -46.58 87.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.95 0.405 . . . . 0.0 110.83 176.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 20.8 m -65.21 -33.05 75.08 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.108 0.48 . . . . 0.0 110.081 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -63.28 -35.77 81.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.642 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.534 HG11 ' HB2' ' A' ' 36' ' ' LEU . 23.0 m -88.46 5.23 4.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-O 120.992 0.425 . . . . 0.0 111.643 -177.279 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 93.53 18.89 36.8 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.662 177.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -121.58 91.01 48.37 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.55 99.46 1.22 Allowed 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 121.982 1.788 . . . . 0.0 112.368 -177.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -109.85 144.29 38.51 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.645 176.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.413 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 24.3 p -81.79 157.81 24.35 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 175.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 53.6 tp -60.78 -32.66 71.97 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.107 0.479 . . . . 0.0 110.568 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -59.78 -42.19 92.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.745 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.435 ' O ' HG13 ' A' ' 82' ' ' ILE . 58.1 mm-40 -59.47 -48.66 80.79 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.291 178.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 46.1 mm -60.36 -48.41 88.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.037 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -63.48 -38.14 90.0 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.861 0.362 . . . . 0.0 110.648 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.6 ttm180 -61.95 -48.71 79.17 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.924 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 78' ' ' GLU . 69.2 mt -64.34 -33.09 60.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.072 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 79.2 mt -79.2 -17.25 55.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.766 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.6 p . . . . . 0 C--O 1.252 1.206 0 CA-C-O 118.308 -0.853 . . . . 0.0 110.621 179.598 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.7 pttp . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -63.67 134.87 46.09 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.127 1.884 . . . . 0.0 111.739 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -105.89 95.73 6.0 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.259 0.552 . . . . 0.0 110.819 -178.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 60.9 t -117.88 98.66 6.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.452 -0.794 . . . . 0.0 108.961 177.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -100.29 93.79 5.86 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.84 -176.158 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 47.3 t-80 -94.86 94.08 7.84 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.2 m -66.56 109.2 2.7 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.254 -175.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 5.3 p-80 -66.01 -28.81 69.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.759 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.7 m -63.23 -32.09 73.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.56 178.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -68.73 -44.11 74.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.833 179.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.418 ' O ' HG23 ' A' ' 29' ' ' VAL . 22.9 ttm180 -68.09 -48.01 66.67 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 175.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -56.62 -44.58 81.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.108 -176.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -67.69 -39.29 84.44 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.959 -0.297 . . . . 0.0 110.598 -177.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.425 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 83.3 mtm180 -69.93 -40.4 75.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.66 -179.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.489 ' O ' HG23 ' A' ' 33' ' ' VAL . 84.6 t -62.49 -42.24 95.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 175.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.6 t -61.95 -42.36 99.03 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.49 178.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -61.37 -36.88 81.46 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 121.268 0.556 . . . . 0.0 110.472 177.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.423 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -73.34 -44.74 58.26 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.05 179.443 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 29' ' ' VAL . 78.2 t -60.81 -43.21 94.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.403 -179.267 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -68.23 -34.61 76.55 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.686 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -72.78 -43.59 62.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.657 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.533 ' HB2' HG12 ' A' ' 70' ' ' VAL . 94.8 mt -68.47 -32.16 71.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.111 0.481 . . . . 0.0 111.327 -178.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.9 mt -86.4 7.05 27.28 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.433 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.601 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 9.5 t70 -81.59 134.8 35.54 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.4 p -56.64 -32.9 65.79 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.696 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -68.13 -43.07 79.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.133 0.492 . . . . 0.0 110.571 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.41 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.5 t -78.04 -24.14 13.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.072 -175.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.601 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 83.9 mtt180 -60.97 -21.8 63.86 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.906 0.384 . . . . 0.0 110.358 173.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -85.69 -18.79 32.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.261 -177.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 p -88.32 155.81 51.48 Favored Pre-proline 0 C--N 1.328 -0.369 0 O-C-N 122.439 -0.163 . . . . 0.0 111.155 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.42 156.32 65.86 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.757 2.304 . . . . 0.0 112.04 176.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.438 ' O ' HG22 ' A' ' 50' ' ' VAL . 2.2 m -60.06 -40.17 88.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.476 -176.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.6 m -58.55 -38.39 77.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.015 -177.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.1 m -65.55 -45.17 84.41 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.629 177.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.557 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 82.1 mttt -57.34 -48.59 78.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.058 178.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.438 HG22 ' O ' ' A' ' 46' ' ' THR . 57.9 t -63.84 -46.02 95.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.191 -177.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 17.0 m170 -64.53 -39.5 93.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.81 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -66.2 -42.72 88.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.097 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 67.3 mt -63.69 -34.76 78.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.804 178.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.451 ' HD3' HD23 ' A' ' 83' ' ' LEU . 33.8 ttpt -61.09 -44.36 97.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.805 0.336 . . . . 0.0 110.222 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.4 p -72.41 -12.98 61.34 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.515 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -81.98 1.35 35.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.859 0.361 . . . . 0.0 110.936 176.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 93.98 14.43 52.03 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.364 178.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.425 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 5.9 mp -91.49 147.99 22.62 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.013 0.435 . . . . 0.0 111.589 179.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.427 ' O ' HG13 ' A' ' 63' ' ' ILE . 1.9 m -92.72 173.25 7.86 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.006 173.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.87 -36.01 76.0 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.712 0.292 . . . . 0.0 111.087 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.7 mp0 -66.43 -45.23 80.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.919 -179.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -62.88 -43.32 99.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.523 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.427 HG13 ' O ' ' A' ' 59' ' ' SER . 78.2 mt -63.08 -45.12 99.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.649 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.5 t -57.78 -45.2 86.33 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.213 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.679 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 33.4 tt0 -67.35 -47.64 69.85 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.602 -178.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.89 -45.38 82.59 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.137 -178.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.564 ' O ' HG22 ' A' ' 70' ' ' VAL . 2.7 m-85 -57.98 -42.23 84.64 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.193 178.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.1 m -67.16 -33.29 75.1 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.177 0.513 . . . . 0.0 110.416 -177.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.679 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 20.1 mtpp -72.39 -29.79 64.07 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.986 -179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.564 HG22 ' O ' ' A' ' 67' ' ' PHE . 10.8 m -83.75 0.27 4.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.854 0.359 . . . . 0.0 111.534 -178.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 96.13 18.33 31.84 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.42 178.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -127.46 91.15 46.7 Favored Pre-proline 0 C--N 1.323 -0.587 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -73.72 93.78 0.86 Allowed 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 121.992 1.795 . . . . 0.0 112.817 -175.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.408 ' HE3' HG22 ' A' ' 46' ' ' THR . 74.2 mmtt -103.65 137.46 41.67 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.482 175.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.439 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 70.0 p -77.47 162.92 26.8 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.263 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 44.3 tp -62.53 -32.63 73.6 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.119 -0.696 . . . . 0.0 109.119 175.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -60.35 -46.32 90.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.818 176.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.439 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 36.7 mm-40 -59.57 -45.88 90.55 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.09 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.405 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 39.4 mm -60.21 -46.78 94.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.524 -177.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -64.39 -39.52 94.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.932 0.396 . . . . 0.0 110.659 177.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.9 tpp180 -60.18 -46.55 89.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.393 177.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.5 mt -67.93 -31.99 54.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.202 -178.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.451 HD23 ' HD3' ' A' ' 54' ' ' LYS . 91.8 mt -82.64 -4.03 57.13 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.741 0.305 . . . . 0.0 111.358 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 45.5 m . . . . . 0 C--O 1.252 1.208 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.614 177.513 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt . . . . . 0 N--CA 1.482 1.125 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -68.84 149.92 73.13 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.372 2.048 . . . . 0.0 111.382 176.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -93.03 22.34 5.06 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.8 0.333 . . . . 0.0 111.409 -176.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 60.1 t -64.67 -43.76 96.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 176.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.417 ' OE1' ' HB2' ' A' ' 25' ' ' ARG . 44.7 mt-10 -122.6 103.56 8.77 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.868 174.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 22.2 p80 -118.52 4.66 11.72 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.927 0.394 . . . . 0.0 110.172 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.9 m -131.57 115.54 16.24 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.855 177.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 42.2 m-70 -64.92 -35.55 81.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.747 -176.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.4 t -63.66 -31.82 73.11 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.919 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.432 ' HA ' ' HE2' ' A' ' 27' ' ' LYS . 41.6 mt-10 -68.55 -40.39 80.67 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 121.061 -0.256 . . . . 0.0 110.647 -179.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.461 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 13.8 ttm180 -66.4 -46.63 75.96 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 174.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -55.96 -44.8 78.81 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.558 -175.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.432 ' HE2' ' HA ' ' A' ' 24' ' ' GLU . 60.4 pttt -68.92 -42.64 76.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.189 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.1 mtm-85 -70.47 -41.13 73.14 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 122.29 -0.256 . . . . 0.0 111.572 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.432 ' O ' HG22 ' A' ' 33' ' ' VAL . 75.2 t -66.01 -39.37 84.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 121.066 -0.253 . . . . 0.0 110.537 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.9 m -58.6 -40.59 83.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.71 0.29 . . . . 0.0 110.49 176.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.426 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 29.8 m-80 -66.55 -36.29 82.31 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.957 177.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.467 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -72.38 -45.22 60.76 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.441 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.488 HG21 ' HE3' ' A' ' 69' ' ' LYS . 78.2 t -61.36 -41.46 89.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.623 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 11.2 pt-20 -68.4 -33.64 74.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 0.0 110.658 178.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -71.88 -43.57 65.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.627 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.514 ' HB2' HG13 ' A' ' 70' ' ' VAL . 96.5 mt -67.75 -30.3 69.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.248 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.8 mt -85.82 4.24 38.01 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.018 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.551 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 18.4 t70 -75.04 132.81 41.58 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 177.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.5 m -53.66 -39.98 65.5 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 -174.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -69.17 -47.47 64.85 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.036 0.445 . . . . 0.0 110.327 178.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.3 t -66.65 -25.64 35.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.975 -177.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.551 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 83.0 mtp180 -65.52 -22.13 66.69 Favored 'General case' 0 C--N 1.319 -0.737 0 O-C-N 122.151 -0.343 . . . . 0.0 111.371 175.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 74.9 mtm180 -101.67 6.99 42.17 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -175.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.457 HG21 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -96.14 169.92 8.32 Favored Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 175.116 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.457 ' HD2' HG21 ' A' ' 44' ' ' THR . 57.2 Cg_endo -71.05 157.53 57.56 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.335 2.023 . . . . 0.0 111.906 175.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.426 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.3 OUTLIER -68.5 -39.83 81.12 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.524 -176.82 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.8 m -58.86 -35.8 73.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.521 -175.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.44 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 70.1 m -64.06 -44.82 91.29 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.221 0.534 . . . . 0.0 110.915 179.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.466 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 24.5 mttm -63.56 -45.47 90.37 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.502 -178.047 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 77.8 t -62.51 -44.62 99.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.57 -177.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 31.1 m170 -64.84 -38.24 90.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.401 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.484 ' O ' ' HG3' ' A' ' 56' ' ' LYS . 55.8 t80 -68.82 -43.37 75.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.725 -179.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 76.8 mt -66.26 -38.7 88.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.756 0.312 . . . . 0.0 110.793 179.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -60.37 -40.6 91.42 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.242 0.544 . . . . 0.0 109.763 173.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.0 t -68.64 -20.03 64.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.244 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' A' ' 52' ' ' PHE . 28.9 mtpp -81.5 -7.83 59.64 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.904 177.047 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.95 10.55 39.65 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.832 178.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.8 mp -82.31 145.13 30.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.276 0.56 . . . . 0.0 111.77 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.448 ' O ' HG13 ' A' ' 63' ' ' ILE . 8.6 m -85.42 164.82 17.66 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.123 175.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.33 -35.44 71.9 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.137 0.494 . . . . 0.0 110.404 178.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -62.79 -48.94 76.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.703 177.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.461 ' OE1' ' HA ' ' A' ' 25' ' ' ARG . 38.6 mt-10 -64.9 -44.49 89.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.242 -177.045 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 59' ' ' SER . 73.2 mt -59.77 -41.79 86.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.258 178.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.1 t -59.31 -44.52 92.55 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.609 178.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -68.3 -45.92 71.72 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.192 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.56 -45.32 81.31 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.515 -178.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.558 ' O ' HG22 ' A' ' 70' ' ' VAL . 7.6 m-85 -59.95 -45.05 93.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.107 0.479 . . . . 0.0 110.934 178.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.0 m -64.82 -33.13 75.26 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.622 -178.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.488 ' HE3' HG21 ' A' ' 33' ' ' VAL . 20.1 mtmt -71.77 -32.14 67.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.652 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 67' ' ' PHE . 13.4 m -81.64 -3.83 7.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.714 0.292 . . . . 0.0 111.286 -177.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 100.01 18.21 22.97 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.298 179.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -126.6 90.94 48.59 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -73.63 97.18 0.95 Allowed 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 121.993 1.795 . . . . 0.0 112.748 -174.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.426 ' HE3' HG21 ' A' ' 46' ' ' THR . 74.3 mmtt -107.38 137.76 44.83 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.914 174.178 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.486 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 45.4 p -82.22 169.21 16.84 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.477 178.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.2 tp -62.9 -33.54 75.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.368 0.604 . . . . 0.0 109.811 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -60.27 -45.44 93.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.798 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.486 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 12.2 mm-40 -60.78 -47.15 87.63 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.052 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 42.6 mm -60.17 -46.15 94.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.805 -177.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 60.3 mttm -64.02 -40.06 95.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.363 . . . . 0.0 111.069 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -64.55 -43.61 93.4 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.74 178.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 72.7 mt -66.92 -31.73 54.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.618 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.9 mt -81.09 -6.85 59.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.482 177.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 14.4 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.433 -0.794 . . . . 0.0 109.746 177.175 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.6 mttm . . . . . 0 N--CA 1.481 1.093 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -73.4 162.43 40.21 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.64 2.227 . . . . 0.0 111.84 177.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.442 ' H ' ' CD ' ' A' ' 17' ' ' GLU . 0.3 OUTLIER -91.82 20.29 5.77 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.126 0.489 . . . . 0.0 111.011 -176.373 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 25.6 t -81.41 -19.26 11.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.814 -178.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -74.44 -37.51 63.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.951 0.405 . . . . 0.0 110.615 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -122.18 87.93 2.84 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 177.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.4 p -72.14 171.23 12.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.528 -175.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 72.8 m-70 -65.36 -42.91 92.27 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.868 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 32.6 t -64.37 -38.04 89.62 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.751 0.31 . . . . 0.0 110.249 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.512 ' O ' ' HG2' ' A' ' 27' ' ' LYS . 27.6 tt0 -65.55 -47.35 76.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.85 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.422 ' O ' HG22 ' A' ' 29' ' ' VAL . 20.7 ptp180 -69.53 -39.04 77.72 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.433 178.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -60.39 -44.46 95.65 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.405 -179.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.512 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 21.7 ptmt -66.43 -37.13 84.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.727 -177.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.543 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 82.7 mtm-85 -68.36 -44.23 75.68 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.862 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.552 ' O ' HG23 ' A' ' 33' ' ' VAL . 94.2 t -60.9 -41.94 90.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 110.027 -0.361 . . . . 0.0 110.027 177.173 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.0 t -60.64 -45.55 93.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.842 0.353 . . . . 0.0 110.404 178.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -62.86 -35.31 79.57 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.996 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.39 -44.73 64.4 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.152 179.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 29' ' ' VAL . 87.4 t -60.98 -42.69 93.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.56 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -68.65 -35.18 76.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.839 179.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -71.76 -43.25 66.09 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-O 120.925 0.393 . . . . 0.0 110.791 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.529 ' HB2' HG12 ' A' ' 70' ' ' VAL . 87.1 mt -65.24 -30.68 71.58 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.329 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.0 mt -85.72 7.47 23.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.979 -178.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.485 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 13.5 t70 -78.99 138.06 37.87 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 176.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.0 m -57.09 -39.63 75.39 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -176.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -68.22 -37.09 80.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.059 0.457 . . . . 0.0 110.412 -179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.545 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 70.7 t -75.13 -34.01 30.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.758 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 84.0 mtp180 -63.84 -21.14 66.3 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.03 0.443 . . . . 0.0 110.303 174.346 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -88.52 -17.49 30.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.026 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.5 p -85.52 159.7 55.18 Favored Pre-proline 0 C--N 1.329 -0.309 0 O-C-N 122.195 -0.316 . . . . 0.0 110.848 177.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.25 158.9 49.81 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.625 2.217 . . . . 0.0 112.021 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.452 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.3 OUTLIER -61.77 -39.6 92.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.541 -176.052 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.419 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 7.6 t -59.38 -43.1 92.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.765 -176.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.3 m -60.33 -42.89 96.57 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.021 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.545 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 79.9 mttt -60.26 -49.1 78.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.001 178.036 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 46' ' ' THR . 59.2 t -65.59 -44.26 93.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.809 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 22.5 m170 -63.9 -37.41 87.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.013 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -66.89 -44.36 81.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.463 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 89.0 mt -66.5 -41.15 89.31 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.887 -178.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.445 ' HD2' ' O ' ' A' ' 58' ' ' LEU . 42.4 tptt -62.84 -37.33 86.4 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.181 0.515 . . . . 0.0 109.926 176.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 35.5 t -70.98 -14.24 62.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.821 178.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 37.4 mtpt -91.46 2.1 56.66 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.998 0.428 . . . . 0.0 110.933 176.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.91 6.12 57.18 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.59 -0.814 . . . . 0.0 113.026 176.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.543 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.4 mp -73.19 153.0 40.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.201 0.524 . . . . 0.0 111.283 178.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.2 m -92.89 161.86 14.31 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.336 172.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.13 -42.61 86.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.798 0.332 . . . . 0.0 111.147 -177.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -62.16 -38.32 88.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.03 178.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.85 -41.98 86.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.048 0.451 . . . . 0.0 110.384 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.402 HG22 HG13 ' A' ' 50' ' ' VAL . 71.8 mt -63.6 -45.2 98.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.402 176.21 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 45.2 t -56.8 -42.6 79.79 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.016 178.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -66.35 -48.42 70.28 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.659 178.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.72 -47.91 78.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.093 -178.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.586 ' O ' HG22 ' A' ' 70' ' ' VAL . 5.2 m-85 -55.29 -46.83 76.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.022 0.439 . . . . 0.0 111.308 178.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.4 m -65.48 -32.63 74.34 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.961 0.41 . . . . 0.0 110.697 -177.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.449 ' HE3' HG22 ' A' ' 33' ' ' VAL . 21.8 mtmt -72.12 -28.88 63.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.769 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.586 HG22 ' O ' ' A' ' 67' ' ' PHE . 10.6 m -84.18 -1.21 6.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.08 0.467 . . . . 0.0 111.193 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.09 14.05 43.72 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.449 178.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -121.22 90.6 47.57 Favored Pre-proline 0 C--N 1.322 -0.615 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -70.87 105.2 1.62 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.012 1.808 . . . . 0.0 112.167 -175.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -116.35 138.39 51.37 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.791 176.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.1 p -82.03 159.28 23.51 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.34 179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 55.4 tp -61.7 -32.85 73.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.287 0.565 . . . . 0.0 109.661 177.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -57.01 -46.38 82.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.018 177.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.434 ' O ' HG13 ' A' ' 82' ' ' ILE . 38.3 mt-10 -63.33 -46.94 84.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.527 179.226 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 46.9 mm -59.93 -44.39 94.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.919 -176.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -63.77 -43.09 97.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.058 0.456 . . . . 0.0 110.773 178.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -63.33 -44.72 94.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.979 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 78' ' ' GLU . 96.4 mt -63.84 -36.64 77.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.101 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 75.5 mt -77.53 -25.39 50.19 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.289 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 7.1 t . . . . . 0 C--O 1.254 1.3 0 CA-C-O 118.181 -0.914 . . . . 0.0 109.996 -179.107 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 93.3 mttt . . . . . 0 N--CA 1.48 1.031 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -82.99 158.39 15.56 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.572 2.181 . . . . 0.0 111.735 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -99.74 61.69 1.15 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.534 0.683 . . . . 0.0 110.661 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 42.9 t -77.66 -44.93 29.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.613 -178.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -71.53 146.52 48.44 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.389 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 -84.76 113.89 21.66 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.377 -177.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.8 p -75.65 110.25 9.9 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.034 176.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 64.2 m170 -62.63 -24.73 67.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.664 -177.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.1 p -61.4 -40.42 94.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.957 177.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.403 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 0.5 OUTLIER -60.87 -43.25 98.69 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.649 178.473 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.451 ' O ' HG23 ' A' ' 29' ' ' VAL . 40.8 ttt180 -67.82 -47.82 67.95 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.061 176.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -60.06 -43.7 95.22 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.742 -175.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -65.02 -38.07 89.7 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.015 -178.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.479 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 88.4 mtm-85 -69.46 -39.55 77.67 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.908 0.385 . . . . 0.0 110.204 177.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.645 ' O ' HG23 ' A' ' 33' ' ' VAL . 71.2 t -62.75 -43.57 98.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.109 174.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 45.3 m -58.0 -45.86 86.16 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.749 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -61.66 -37.64 84.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.092 0.472 . . . . 0.0 110.928 178.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.49 -44.38 62.34 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.46 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 29' ' ' VAL . 67.7 t -61.07 -43.3 95.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.023 0.44 . . . . 0.0 110.355 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -69.22 -35.96 76.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.794 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -72.32 -43.48 64.09 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.834 0.35 . . . . 0.0 110.994 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.521 ' HB2' HG11 ' A' ' 70' ' ' VAL . 75.0 mt -63.61 -31.1 72.16 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.491 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.415 HD22 ' HA ' ' A' ' 37' ' ' LEU . 11.7 mt -85.89 6.99 25.83 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -178.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -77.07 139.38 39.99 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.717 -0.393 . . . . 0.0 109.989 177.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.542 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 14.5 m -57.89 -37.04 73.26 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.933 -175.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 33.4 mmt180 -69.57 -38.5 77.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.155 0.502 . . . . 0.0 110.587 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.575 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 58.2 t -74.5 -34.52 35.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.132 -176.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' A' ' 39' ' ' SER . 22.4 ptt180 -67.63 -21.37 65.39 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.877 0.37 . . . . 0.0 110.254 176.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -89.28 -7.11 56.1 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.686 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.4 p -96.96 158.4 33.46 Favored Pre-proline 0 C--N 1.326 -0.451 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.012 176.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -62.46 154.88 61.31 Favored 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.703 2.268 . . . . 0.0 111.95 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.431 ' O ' HG23 ' A' ' 50' ' ' VAL . 1.3 m -60.27 -35.63 75.96 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.859 -178.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.3 m -58.24 -42.87 87.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.786 -178.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.2 m -63.25 -45.74 90.15 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.873 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.575 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 82.2 mttt -57.46 -49.99 74.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.179 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 46' ' ' THR . 80.9 t -64.23 -43.54 97.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.925 -176.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 26.2 m170 -64.56 -37.48 87.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.081 -178.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -69.68 -42.68 73.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.387 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 68.7 mt -64.46 -39.26 93.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.674 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.415 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 29.8 tptt -63.87 -39.93 95.36 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 120.967 0.413 . . . . 0.0 110.102 176.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.2 t -69.63 -14.35 62.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.713 178.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -83.86 -1.61 54.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.793 176.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.42 17.92 47.72 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.627 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.479 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.4 mp -83.03 159.0 22.27 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.265 0.555 . . . . 0.0 111.043 177.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.1 m -100.59 165.23 11.51 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.438 -0.801 . . . . 0.0 108.897 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.95 -34.51 69.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.906 0.384 . . . . 0.0 110.821 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.97 -49.62 76.95 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.905 177.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -63.67 -43.64 96.12 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.902 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 78.5 mt -60.84 -44.96 98.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.715 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.6 t -60.81 -43.39 98.25 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.7 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.429 ' CD ' HH21 ' A' ' 25' ' ' ARG . 27.5 tt0 -68.85 -48.54 63.22 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.123 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.79 -41.57 82.39 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 120.726 0.298 . . . . 0.0 111.551 -178.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -60.93 -45.43 94.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.578 176.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 20.8 m -64.85 -34.33 78.11 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.043 0.449 . . . . 0.0 110.292 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.0 mmmt -63.14 -32.5 73.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.962 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.521 HG11 ' HB2' ' A' ' 36' ' ' LEU . 24.1 m -91.95 8.1 4.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.97 0.414 . . . . 0.0 111.401 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.41 23.7 33.34 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.794 177.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -126.61 91.31 47.71 Favored Pre-proline 0 C--N 1.32 -0.682 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 176.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -72.09 102.92 1.41 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 121.899 1.732 . . . . 0.0 111.744 -178.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -108.93 139.35 43.91 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.657 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 38.1 p -80.49 156.64 26.45 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.183 178.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 38.9 tp -63.25 -32.69 74.16 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.126 0.488 . . . . 0.0 109.943 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -60.36 -45.17 94.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.723 177.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -59.04 -47.58 84.72 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.511 177.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.0 mm -59.8 -45.19 95.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.433 -178.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.2 -44.99 93.79 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.868 0.366 . . . . 0.0 110.874 177.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.3 tpp180 -61.65 -47.22 86.38 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.943 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 86.3 mt -64.6 -34.45 69.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.765 -179.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 80.8 mt -81.61 -4.3 55.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.794 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 38.4 m . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.836 -0.602 . . . . 0.0 110.282 176.004 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 120.761 0.315 . . . . 0.0 110.339 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.73 145.88 20.63 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.548 2.165 . . . . 0.0 111.614 176.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -90.6 91.28 8.35 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.103 0.478 . . . . 0.0 110.302 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 45.9 t -116.78 -59.25 3.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.467 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -69.91 148.4 49.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.392 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 23.8 m-70 63.07 166.55 0.13 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.872 -174.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.4 m 62.7 -75.92 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 122.744 0.417 . . . . 0.0 111.159 -178.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 68.0 m80 -66.15 -45.39 81.14 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.4 t -67.67 -37.89 83.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.377 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -68.1 -40.28 82.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.682 -178.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 41.6 ttt180 -68.11 -47.85 67.04 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 120.732 0.301 . . . . 0.0 110.255 175.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -57.64 -44.02 85.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.642 -175.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -67.6 -40.27 84.75 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.969 -178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 51.6 mtm-85 -69.74 -40.23 76.3 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.52 0.2 . . . . 0.0 111.138 -177.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.643 ' O ' HG21 ' A' ' 33' ' ' VAL . 81.6 t -60.57 -43.7 95.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 175.103 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.3 m -62.16 -38.23 88.25 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.198 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.417 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 95.1 m-20 -61.79 -37.13 83.21 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.25 0.547 . . . . 0.0 110.382 177.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.05 -44.92 52.54 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.211 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.643 HG21 ' O ' ' A' ' 29' ' ' VAL . 61.8 t -61.58 -39.94 84.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.832 0.349 . . . . 0.0 110.544 -178.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 12.7 pt-20 -68.72 -38.46 80.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.91 178.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -72.38 -43.28 64.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.821 0.343 . . . . 0.0 110.935 -179.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.519 ' HB2' HG13 ' A' ' 70' ' ' VAL . 88.7 mt -66.15 -31.15 71.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.595 -177.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.3 mt -86.03 4.62 37.12 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.554 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 12.4 t70 -75.46 138.18 41.45 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.233 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.2 t -53.95 -37.71 64.17 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.389 -178.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 73.2 mtm180 -68.54 -46.52 69.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.393 0.616 . . . . 0.0 110.414 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.435 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.2 t -71.41 -29.46 35.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.209 -174.04 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.554 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 78.6 mtp180 -65.38 -21.96 66.74 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.213 177.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 25.2 mtm180 -90.12 -17.09 28.3 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.646 0.239 . . . . 0.0 111.646 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.3 p -83.64 159.17 61.59 Favored Pre-proline 0 C--N 1.326 -0.42 0 C-N-CA 121.238 -0.185 . . . . 0.0 110.89 177.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.44 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 35.8 Cg_endo -65.09 159.45 46.63 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.659 2.24 . . . . 0.0 112.512 177.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.403 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.7 OUTLIER -61.76 -39.73 92.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.22 -177.749 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 5.9 m -58.26 -40.96 83.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.278 -177.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 63.7 m -62.97 -46.64 86.76 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.736 177.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.531 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 80.7 mttt -56.99 -49.01 77.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.313 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 46' ' ' THR . 91.2 t -64.2 -45.02 97.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.268 -176.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 17.8 m170 -64.84 -38.93 92.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.017 -178.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -64.14 -42.93 96.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.277 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 87.7 mt -65.71 -37.97 87.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.848 -179.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -60.84 -42.24 97.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.005 174.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.4 t -69.59 -13.67 62.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.631 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.8 mmpt? -85.6 -3.04 58.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.626 175.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.1 17.37 40.68 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.637 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.2 mp -88.38 152.53 21.85 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.397 0.618 . . . . 0.0 111.934 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.2 m -93.52 164.91 13.0 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.743 175.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.23 -37.46 74.9 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.897 0.379 . . . . 0.0 110.839 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -62.44 -46.87 86.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.42 178.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -65.63 -40.5 92.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.621 -177.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 87.8 mt -64.64 -45.8 94.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.608 177.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 31.3 t -56.68 -44.76 81.78 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.165 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -68.27 -45.86 71.97 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.066 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 69' ' ' LYS . . . -57.76 -40.76 80.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.737 0.303 . . . . 0.0 111.473 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -60.04 -45.41 92.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.654 176.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.3 m -65.32 -33.08 75.13 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.229 0.538 . . . . 0.0 109.803 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 66' ' ' ALA . 27.0 mmmt -62.06 -35.77 79.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.937 177.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.519 HG13 ' HB2' ' A' ' 36' ' ' LEU . 22.1 m -89.89 5.37 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.822 0.344 . . . . 0.0 111.577 -176.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 94.66 13.5 53.31 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.875 176.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -119.42 90.81 43.21 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -72.43 102.31 1.37 Allowed 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 121.849 1.699 . . . . 0.0 112.053 -178.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -111.21 138.42 47.67 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.837 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 32.9 p -76.74 158.9 30.61 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.516 178.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 49.5 tp -62.99 -32.96 74.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.146 0.498 . . . . 0.0 109.947 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -58.72 -45.29 89.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.758 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.4 ' O ' HG13 ' A' ' 82' ' ' ILE . 45.2 mm-40 -59.14 -48.76 80.43 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.521 178.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.7 mm -60.51 -44.19 95.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.678 -177.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -63.14 -44.04 96.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.932 177.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -60.99 -43.0 99.47 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.109 178.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 78' ' ' GLU . 77.0 mt -66.68 -36.58 77.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.942 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 83.6 mt -77.74 -24.66 48.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.403 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 51.8 p . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.613 -0.708 . . . . 0.0 110.317 179.378 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.6 pttp . . . . . 0 N--CA 1.477 0.922 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.15 128.61 16.85 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.447 2.098 . . . . 0.0 111.989 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -95.56 93.87 7.43 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.288 0.565 . . . . 0.0 110.225 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.5 t -93.84 -56.93 4.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.749 178.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -100.88 -173.79 2.47 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.22 176.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 40.0 m80 -80.3 -43.91 20.48 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.601 -0.439 . . . . 0.0 110.745 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.49 HG23 ' H ' ' A' ' 24' ' ' GLU . 9.9 t -170.57 162.25 7.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.762 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -61.26 -34.4 75.1 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.491 176.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.8 t -61.92 -30.12 70.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.975 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.554 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 34.0 tt0 -71.55 -47.74 53.14 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.429 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -66.08 -36.72 83.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -62.92 -45.92 90.25 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.242 178.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -70.8 -32.23 69.25 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.9 -177.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.554 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 29.0 mtm180 -62.52 -47.36 84.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.799 0.333 . . . . 0.0 110.379 178.124 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.475 ' O ' HG22 ' A' ' 33' ' ' VAL . 75.6 t -65.0 -39.89 87.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.075 177.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.0 m -58.04 -46.57 85.13 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.775 177.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -63.02 -36.47 83.68 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.172 178.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.68 -44.92 63.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.05 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.475 HG22 ' O ' ' A' ' 29' ' ' VAL . 82.2 t -61.18 -43.13 95.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.55 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -68.36 -35.53 77.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.9 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -72.43 -43.76 63.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.813 0.34 . . . . 0.0 110.677 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.526 ' HB2' HG12 ' A' ' 70' ' ' VAL . 86.6 mt -64.8 -29.95 70.94 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.563 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 19.6 mt -85.04 7.69 20.54 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.088 -176.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.651 ' OD2' ' HG2' ' A' ' 40' ' ' ARG . 9.4 t70 -85.37 139.06 31.86 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.104 177.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.649 ' O ' ' HG3' ' A' ' 43' ' ' ARG . 27.1 t -55.52 -41.15 72.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.238 -178.068 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.651 ' HG2' ' OD2' ' A' ' 38' ' ' ASP . 11.0 ptm180 -67.81 -32.56 73.21 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.035 0.445 . . . . 0.0 110.646 -177.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.555 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 98.8 t -78.98 -33.18 15.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.444 -178.34 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 82.7 mtp180 -66.56 -22.04 66.15 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.909 175.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.649 ' HG3' ' O ' ' A' ' 39' ' ' SER . 67.9 mtt180 -86.15 -18.32 32.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.464 -178.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.08 158.73 58.15 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 121.187 -0.205 . . . . 0.0 110.822 177.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.37 154.02 73.66 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.381 2.054 . . . . 0.0 112.015 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -34.43 73.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.952 -177.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.6 p -58.54 -43.1 89.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.843 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 62.0 m -64.78 -44.67 89.24 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.124 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.555 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 82.9 mttt -56.98 -49.38 75.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.078 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 62.3 t -67.73 -43.62 86.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.009 -176.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 25.2 m170 -65.04 -36.68 85.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.595 -177.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.441 ' O ' ' HG3' ' A' ' 56' ' ' LYS . 72.6 t80 -69.94 -45.45 67.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.45 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 98.9 mt -62.87 -40.84 98.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.075 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 46.5 tptt -62.96 -40.0 96.36 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.427 177.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.3 t -70.79 -13.78 62.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.637 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 52' ' ' PHE . 39.4 mtpt -86.12 -2.8 58.67 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.189 177.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 102.04 9.22 42.98 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.886 177.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.445 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.9 mp -80.6 156.01 26.62 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.44 0.638 . . . . 0.0 111.62 178.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.405 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 20.1 m -98.71 168.89 9.86 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.538 174.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.18 95.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.686 0.279 . . . . 0.0 111.113 -177.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -60.53 -40.85 93.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.938 177.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.405 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 6.3 mm-40 -63.1 -47.97 80.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.961 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 61.9 mt -64.65 -45.41 95.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.72 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.6 t -56.98 -45.02 83.25 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.946 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -67.76 -47.02 70.42 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.909 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.434 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -57.19 -47.26 81.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.052 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.563 ' O ' HG21 ' A' ' 70' ' ' VAL . 2.7 m-85 -56.44 -44.23 80.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.105 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.1 m -66.15 -33.54 76.01 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.807 0.337 . . . . 0.0 110.65 -177.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.41 ' HE3' HG21 ' A' ' 33' ' ' VAL . 22.4 mtmt -70.91 -30.95 67.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.795 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.563 HG21 ' O ' ' A' ' 67' ' ' PHE . 7.9 m -83.47 -0.83 5.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.848 0.356 . . . . 0.0 111.287 -177.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 96.28 19.87 26.91 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.483 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -127.81 91.3 45.57 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 177.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.84 101.14 1.15 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 121.892 1.728 . . . . 0.0 112.57 -175.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -109.46 139.35 44.55 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.044 176.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 34.7 p -82.45 164.55 20.89 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.113 176.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.1 tp -63.08 -32.73 74.18 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 176.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -59.52 -45.62 91.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.475 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -58.69 -46.94 86.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.216 178.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 41.6 mm -61.59 -45.36 98.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.786 -177.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -64.14 -39.53 94.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.998 0.428 . . . . 0.0 110.479 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -59.89 -48.63 80.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.898 177.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.3 mt -69.85 -33.37 55.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.828 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 75.5 mt -82.97 1.64 38.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.745 0.307 . . . . 0.0 111.598 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 26.2 t . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.577 -0.725 . . . . 0.0 109.264 176.026 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.445 ' O ' ' HD3' ' A' ' 15' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 120.603 0.24 . . . . 0.0 110.55 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -76.25 155.94 37.36 Favored 'Trans proline' 0 N--CA 1.461 -0.396 0 C-N-CA 122.899 2.399 . . . . 0.0 112.452 179.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -96.05 12.33 30.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.595 0.712 . . . . 0.0 110.096 176.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.9 p -109.95 115.59 50.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.059 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -137.86 147.45 44.5 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.561 -178.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -102.64 -59.76 1.65 Allowed 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 174.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.1 m -83.08 88.29 6.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.386 -178.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.401 ' O ' ' HG2' ' A' ' 25' ' ' ARG . 87.0 m-70 -73.12 -27.07 61.48 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.915 -178.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 32.2 t -62.33 -29.69 70.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.737 178.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.516 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 43.0 tt0 -65.82 -47.39 75.22 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.971 -0.291 . . . . 0.0 110.531 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.401 ' HG2' ' O ' ' A' ' 22' ' ' HIS . 29.0 ptt180 -68.43 -36.87 79.67 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.465 -0.494 . . . . 0.0 109.888 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -64.43 -43.94 92.73 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.944 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 63.6 pttt -67.27 -32.53 73.61 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.387 -179.017 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.516 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 21.2 mtm180 -65.46 -45.52 83.42 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.642 ' O ' HG21 ' A' ' 33' ' ' VAL . 73.3 t -60.63 -46.39 95.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.843 175.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.1 t -59.68 -42.83 93.82 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.171 -179.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -61.83 -36.85 82.39 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.051 0.453 . . . . 0.0 110.632 177.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.44 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -72.28 -41.86 66.21 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.878 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.642 HG21 ' O ' ' A' ' 29' ' ' VAL . 93.6 t -61.0 -46.55 96.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 120.869 0.366 . . . . 0.0 110.246 179.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -68.75 -33.65 74.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.815 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -71.42 -43.59 66.48 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.056 0.455 . . . . 0.0 110.615 179.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.558 ' HB2' HG12 ' A' ' 70' ' ' VAL . 93.2 mt -66.81 -32.24 73.4 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.884 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.2 mt -88.69 6.31 39.09 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -77.24 138.18 39.26 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.5 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 48.7 m -59.81 -33.93 72.39 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 -176.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.436 ' HG2' HG22 ' A' ' 41' ' ' VAL . 7.5 ptp180 -70.63 -40.58 73.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.069 0.461 . . . . 0.0 110.142 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.436 HG22 ' HG2' ' A' ' 40' ' ' ARG . 47.6 t -80.32 -26.96 11.7 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.856 -173.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.5 ' HG2' ' O ' ' A' ' 39' ' ' SER . 37.5 ptt180 -64.37 -20.29 66.03 Favored 'General case' 0 C--N 1.318 -0.799 0 O-C-N 121.738 -0.601 . . . . 0.0 111.222 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -83.43 -17.77 40.99 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -176.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.481 ' C ' ' HZ1' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -85.98 169.84 14.46 Favored Pre-proline 0 CA--C 1.536 0.442 0 O-C-N 122.44 -0.163 . . . . 0.0 111.348 -176.118 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.444 ' HD2' HG22 ' A' ' 44' ' ' THR . 44.2 Cg_endo -69.14 162.88 39.94 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.467 2.111 . . . . 0.0 112.191 174.455 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.46 -45.01 73.59 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.834 -176.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.1 m -58.44 -38.01 76.6 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.95 -174.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.8 m -60.27 -42.86 96.3 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 121.114 0.483 . . . . 0.0 110.873 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.481 ' HZ1' ' C ' ' A' ' 44' ' ' THR . 25.3 mttm -63.71 -45.0 91.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.516 -178.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 60.3 t -63.17 -43.25 98.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.653 -178.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -64.59 -37.62 88.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.658 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -67.27 -46.27 74.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.531 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 96.2 mt -61.86 -39.62 92.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.746 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 51.1 tptt -59.87 -42.81 94.53 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.518 175.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.0 t -70.97 -19.32 62.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.841 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 55.3 mmtt -82.04 -3.56 54.86 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.989 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 102.14 9.0 43.29 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.566 -0.826 . . . . 0.0 112.824 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.459 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.4 mp -82.55 149.36 27.54 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.381 0.61 . . . . 0.0 111.315 179.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.6 m -94.18 169.58 10.14 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.559 174.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.1 -37.78 77.96 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.861 0.363 . . . . 0.0 110.875 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.21 -44.85 92.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.401 177.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -63.17 -48.29 79.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.877 -178.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 61.3 mt -63.38 -43.54 98.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.946 -178.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 52.6 t -57.51 -44.1 84.75 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.848 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -68.57 -48.46 64.17 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.905 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.18 -41.11 78.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.883 -178.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.429 ' O ' HG23 ' A' ' 70' ' ' VAL . 6.6 m-85 -61.26 -45.9 92.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.849 0.357 . . . . 0.0 110.635 177.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.5 m -63.08 -35.35 79.95 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.105 0.479 . . . . 0.0 110.125 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 29.0 mmtt -60.93 -36.46 79.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.45 178.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.558 HG12 ' HB2' ' A' ' 36' ' ' LEU . 18.6 m -90.6 9.59 3.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.543 -175.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.62 16.07 57.32 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.799 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -121.75 90.64 48.39 Favored Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 177.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.07 95.86 0.85 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 121.955 1.77 . . . . 0.0 112.588 -176.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -103.63 137.72 41.29 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.678 175.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 41.7 p -77.68 161.72 27.56 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.136 177.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.452 ' HG ' ' HE3' ' A' ' 80' ' ' LYS . 62.6 tp -61.65 -32.94 73.13 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -60.34 -44.25 95.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.997 176.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -57.45 -49.13 77.25 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.088 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 41.1 mm -60.77 -41.83 89.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.449 -177.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.452 ' HE3' ' HG ' ' A' ' 76' ' ' LEU . 96.1 mttt -61.18 -44.08 97.87 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.151 177.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.0 tpp180 -62.58 -46.14 89.7 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.598 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 83.9 mt -65.3 -36.56 78.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.131 -178.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 72.2 mt -80.91 -4.57 55.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.617 0.246 . . . . 0.0 111.638 178.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 19.9 t . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.732 -0.652 . . . . 0.0 109.629 178.033 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.6 mttt . . . . . 0 N--CA 1.479 1.011 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -80.56 122.43 4.5 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 122.685 2.256 . . . . 0.0 112.155 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -85.19 87.61 7.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.305 0.574 . . . . 0.0 110.238 -178.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 21.2 t -115.67 -23.06 4.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.5 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -72.16 109.53 6.0 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.896 -178.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 33.2 m80 65.08 84.13 0.16 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.197 -178.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 31.4 m -109.56 -67.81 0.96 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.354 177.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -73.3 -34.02 65.5 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.705 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.8 p -56.87 -37.25 71.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.219 -178.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.478 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 8.2 mm-40 -69.29 -46.73 66.48 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.987 -175.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.428 ' O ' HG21 ' A' ' 29' ' ' VAL . 7.3 ptm180 -69.73 -37.32 76.48 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.284 -0.566 . . . . 0.0 109.929 176.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -62.94 -43.6 98.34 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.364 -177.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -65.16 -35.02 79.78 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.259 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.478 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 21.2 mtm180 -70.04 -41.55 74.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.344 178.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.457 ' O ' HG21 ' A' ' 33' ' ' VAL . 69.3 t -61.1 -44.52 98.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.09 174.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.3 m -60.84 -43.29 98.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.837 178.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -61.75 -35.84 79.28 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.068 0.461 . . . . 0.0 110.681 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.468 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -72.07 -44.8 62.74 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.953 178.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.457 HG21 ' O ' ' A' ' 29' ' ' VAL . 67.7 t -60.98 -43.42 96.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.684 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -67.88 -35.9 79.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.67 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -72.26 -43.7 63.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.902 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.539 ' HB2' HG12 ' A' ' 70' ' ' VAL . 93.1 mt -65.12 -31.35 72.5 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.453 -178.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.8 mt -85.79 -0.68 55.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.222 -0.444 . . . . 0.0 112.086 -176.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -69.26 138.18 53.71 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 11.8 m -63.05 -30.5 71.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.843 0.354 . . . . 0.0 111.526 -175.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -69.34 -38.3 78.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.365 0.603 . . . . 0.0 110.39 175.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.7 t -79.24 -36.35 18.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.251 -172.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -62.13 -20.28 63.91 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 120.859 0.361 . . . . 0.0 110.796 176.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 43' ' ' ARG . 40.7 ttm180 -85.21 -18.92 32.59 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.586 -178.51 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.484 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -89.13 168.38 15.54 Favored Pre-proline 0 CA--C 1.536 0.405 0 CA-C-N 116.85 -0.159 . . . . 0.0 110.989 -177.657 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.484 ' HD2' HG22 ' A' ' 44' ' ' THR . 49.2 Cg_endo -68.18 156.88 64.13 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.695 2.264 . . . . 0.0 111.975 176.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.419 HG22 ' HE3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -68.12 -33.97 75.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.065 -177.491 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.515 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 20.6 m -58.28 -40.75 82.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.518 -177.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 54.7 m -59.84 -48.02 83.36 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.089 178.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.471 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 2.2 mttp -58.17 -48.8 79.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.21 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 58.3 t -64.02 -41.58 92.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.747 -175.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -65.12 -39.28 92.85 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.368 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -65.18 -48.81 72.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.48 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 85.0 mt -62.68 -39.56 94.32 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.045 -177.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -60.51 -42.83 97.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.021 0.439 . . . . 0.0 110.236 175.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 45.7 m -68.77 -19.71 64.32 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.827 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -80.83 -8.22 59.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.732 176.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.52 8.32 37.99 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.826 177.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.5 mp -80.07 144.72 32.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.252 0.549 . . . . 0.0 111.842 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.429 ' O ' HG13 ' A' ' 63' ' ' ILE . 6.1 m -86.46 165.42 16.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.37 174.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.25 -38.8 84.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.994 0.426 . . . . 0.0 110.929 -178.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -65.49 -37.55 87.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.909 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -67.1 -48.05 69.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.54 177.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 59' ' ' SER . 73.7 mt -59.31 -44.89 93.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.537 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.4 t -56.61 -43.35 80.07 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.788 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.687 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 32.5 tt0 -67.93 -48.31 66.3 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.925 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.25 -43.77 79.02 Favored 'General case' 0 CA--C 1.519 -0.24 0 O-C-N 123.147 0.279 . . . . 0.0 110.965 -178.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.563 ' O ' HG21 ' A' ' 70' ' ' VAL . 7.0 m-85 -58.57 -43.88 89.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.944 0.402 . . . . 0.0 110.954 177.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.8 m -65.96 -33.13 75.11 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.112 0.482 . . . . 0.0 110.618 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.687 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 25.2 mtpp -72.33 -30.35 64.68 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.91 -179.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.563 HG21 ' O ' ' A' ' 67' ' ' PHE . 14.4 m -84.2 1.66 4.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.939 0.4 . . . . 0.0 111.201 -179.132 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.07 12.88 47.94 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.561 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -121.53 90.72 48.12 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.73 103.48 1.46 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 121.776 1.65 . . . . 0.0 112.001 -176.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.419 ' HE3' HG22 ' A' ' 46' ' ' THR . 71.3 mmtt -111.87 138.28 48.69 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.004 177.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 50.9 p -80.09 167.8 19.95 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.047 176.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.4 ' O ' ' HG3' ' A' ' 80' ' ' LYS . 47.4 tp -63.56 -32.66 74.19 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 176.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -59.22 -45.46 91.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.832 176.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -56.31 -49.08 75.33 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.33 179.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 39.7 mm -63.45 -48.8 85.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.835 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 76' ' ' LEU . 48.8 mttm -64.37 -39.63 94.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.41 -178.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -64.97 -44.69 88.54 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.116 0.484 . . . . 0.0 110.634 178.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.515 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 97.4 mt -65.48 -32.49 58.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.985 178.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 71.2 mt -79.36 -8.79 59.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.19 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 15.3 t . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.491 -0.766 . . . . 0.0 109.566 178.513 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 24.2 pttm . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 120.706 0.288 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.82 160.27 37.62 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.435 2.09 . . . . 0.0 111.535 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -97.83 9.31 42.99 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.933 0.397 . . . . 0.0 110.659 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 43.8 t -72.65 93.2 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 62.88 6.03 2.02 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.107 -172.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 60.3 -171.55 0.13 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 123.402 0.681 . . . . 0.0 111.542 178.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 40.8 m -69.29 109.03 3.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.121 0.486 . . . . 0.0 110.379 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -63.07 -41.33 99.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.599 -175.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.3 m -59.81 -35.54 74.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.356 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 27' ' ' LYS . 36.6 tt0 -70.11 -46.58 64.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.692 0.282 . . . . 0.0 110.821 -178.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.614 ' HB2' ' OE2' ' A' ' 62' ' ' GLU . 0.3 OUTLIER -68.07 -36.14 79.35 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.2 -0.6 . . . . 0.0 109.685 179.57 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -58.08 -44.19 87.43 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.986 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 64.7 pttt -71.91 -33.26 68.16 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.621 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.451 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 53.2 mtm180 -65.47 -48.0 74.17 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.705 0.288 . . . . 0.0 110.482 177.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.492 ' O ' HG21 ' A' ' 33' ' ' VAL . 76.5 t -61.74 -42.96 96.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.171 177.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.7 m -58.89 -45.66 89.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.908 178.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -62.0 -36.86 82.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.995 0.426 . . . . 0.0 111.135 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.75 -45.37 61.92 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.969 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.492 HG21 ' O ' ' A' ' 29' ' ' VAL . 90.6 t -61.22 -42.75 94.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.616 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.42 -35.82 76.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.168 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -71.21 -43.23 67.76 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.948 0.404 . . . . 0.0 110.553 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.522 ' HB2' HG13 ' A' ' 70' ' ' VAL . 88.9 mt -65.34 -29.19 69.89 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.284 179.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.8 mt -85.67 6.35 27.98 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.69 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 13.4 t70 -79.72 133.56 36.35 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.661 -0.415 . . . . 0.0 109.939 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.5 m -52.96 -38.96 62.58 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 123.495 0.497 . . . . 0.0 112.044 -175.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -69.61 -36.68 76.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.128 0.49 . . . . 0.0 110.742 -179.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.521 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 61.5 t -76.8 -21.81 14.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.464 0.649 . . . . 0.0 110.385 -178.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.69 ' HG2' ' O ' ' A' ' 38' ' ' ASP . 20.4 mmm180 -64.08 -25.81 68.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.256 173.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -91.64 -17.98 24.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.542 -173.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.4 p -82.71 158.41 65.49 Favored Pre-proline 0 C--N 1.326 -0.447 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.123 -177.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -65.5 153.96 75.84 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.444 2.096 . . . . 0.0 111.754 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.57 -37.62 78.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.196 -177.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.498 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 18.9 m -58.76 -41.3 86.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.379 -177.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.6 m -63.57 -44.6 93.63 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.851 178.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.521 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 81.5 mttt -58.12 -48.26 80.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.398 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 85.2 t -66.96 -45.08 88.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.427 -176.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -64.38 -35.81 82.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.784 -177.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -67.14 -46.1 75.12 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.389 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 94.7 mt -64.25 -37.88 89.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.784 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.422 ' HD3' HD23 ' A' ' 83' ' ' LEU . 29.6 ttpt -63.26 -39.31 94.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.02 0.438 . . . . 0.0 109.94 176.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 44.3 m -68.71 -15.77 63.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.91 179.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -85.24 -4.08 59.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.613 175.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.09 1.68 55.94 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.854 -0.688 . . . . 0.0 112.694 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.451 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.4 mp -71.67 148.55 46.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.099 0.476 . . . . 0.0 111.364 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.442 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 9.4 m -90.79 165.98 13.36 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.286 175.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.86 -39.55 78.04 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.677 0.275 . . . . 0.0 111.683 -177.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -67.76 -35.07 78.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.39 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.614 ' OE2' ' HB2' ' A' ' 25' ' ' ARG . 4.1 mm-40 -64.96 -45.2 86.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.473 0.654 . . . . 0.0 109.48 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 67.8 mt -62.81 -42.1 95.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.291 177.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 32.1 t -56.8 -46.64 81.46 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.343 177.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -67.67 -48.13 67.5 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.712 -178.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.81 -45.76 82.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.295 -178.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.551 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.1 m-85 -57.49 -45.1 85.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.898 0.38 . . . . 0.0 111.241 178.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.3 m -65.14 -33.23 75.52 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.94 0.4 . . . . 0.0 110.431 -177.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.419 ' HE3' HG23 ' A' ' 33' ' ' VAL . 21.3 mtmt -72.1 -27.73 62.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.607 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.551 HG22 ' O ' ' A' ' 67' ' ' PHE . 8.4 m -88.79 7.49 3.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.736 0.303 . . . . 0.0 111.657 -179.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 93.05 17.21 44.48 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.743 176.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -127.22 91.08 47.38 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -68.19 105.72 1.25 Allowed 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 122.006 1.804 . . . . 0.0 112.195 -176.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -116.41 139.12 50.77 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.836 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 21.6 p -87.46 167.59 13.85 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.302 176.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 51.6 tp -63.63 -33.35 75.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.19 0.519 . . . . 0.0 109.676 176.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -57.77 -45.73 85.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.692 177.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -57.73 -48.36 79.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.994 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 36.5 mm -63.72 -46.02 95.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.813 -175.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -60.96 -43.05 99.31 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.07 0.462 . . . . 0.0 110.298 177.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.5 tpp180 -60.05 -45.12 93.89 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.434 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.498 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 86.9 mt -67.39 -35.07 72.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.964 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.422 HD23 ' HD3' ' A' ' 54' ' ' LYS . 84.3 mt -82.1 -0.18 43.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.382 179.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 50.7 m . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.581 -0.723 . . . . 0.0 110.131 175.71 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.2 mttm . . . . . 0 N--CA 1.477 0.883 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -89.3 37.72 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.988 2.459 . . . . 0.0 112.457 179.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -110.98 16.68 21.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.939 0.399 . . . . 0.0 111.175 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 45.5 t -75.59 -35.52 31.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 173.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -83.22 78.71 9.57 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.46 -1.245 . . . . 0.0 109.737 173.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -79.73 -33.2 41.02 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.689 -175.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.615 ' HB ' ' OE2' ' A' ' 24' ' ' GLU . 12.2 p -126.1 98.47 5.5 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.341 0.591 . . . . 0.0 111.159 -176.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -70.07 -43.9 70.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.071 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.9 m -64.12 -38.64 91.79 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.864 -178.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.615 ' OE2' ' HB ' ' A' ' 21' ' ' THR . 10.9 mp0 -65.6 -44.82 85.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.532 177.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 -63.45 -43.1 98.37 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.99 0.424 . . . . 0.0 110.231 176.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -59.21 -44.49 92.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.375 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.546 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 22.2 ptmt -69.76 -38.27 76.71 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.929 -0.308 . . . . 0.0 110.633 -177.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.548 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 60.2 mtm180 -63.84 -45.36 89.86 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.704 0.287 . . . . 0.0 110.626 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.481 ' O ' HG23 ' A' ' 33' ' ' VAL . 85.0 t -64.31 -41.44 92.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.415 177.184 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.4 m -62.08 -42.98 99.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.247 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -61.91 -35.65 79.0 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.172 0.51 . . . . 0.0 110.652 176.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.35 -44.91 61.93 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.243 179.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 29' ' ' VAL . 71.5 t -60.87 -43.23 95.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.861 0.362 . . . . 0.0 110.527 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -68.31 -36.0 78.67 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.728 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 92.9 t80 -72.09 -44.17 63.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.841 0.353 . . . . 0.0 110.634 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.537 ' HB2' HG13 ' A' ' 70' ' ' VAL . 86.3 mt -62.74 -31.16 72.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.491 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.0 mt -85.95 3.16 43.3 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -176.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.604 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 13.5 t70 -78.99 138.17 37.93 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.061 178.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.7 m -57.21 -38.07 73.17 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -176.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.5 ptp180 -68.6 -32.81 72.96 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.539 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 66.6 t -79.43 -31.16 14.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.261 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.604 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 86.9 mtt180 -61.82 -26.72 68.29 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.224 0.535 . . . . 0.0 109.646 173.048 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.431 ' HA ' ' NE ' ' A' ' 43' ' ' ARG . 6.8 tpm_? -85.71 -19.21 31.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.515 -178.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.1 p -82.6 155.18 68.67 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 122.057 -0.402 . . . . 0.0 110.688 178.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.411 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 35.3 Cg_endo -66.63 157.13 62.4 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.444 2.096 . . . . 0.0 111.777 175.261 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.404 ' O ' HG21 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -59.65 -34.98 73.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.88 -178.076 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.7 p -58.58 -43.5 89.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.229 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 71.1 m -65.24 -44.37 88.42 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.846 179.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.544 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 81.3 mttt -57.35 -49.64 75.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.123 -179.239 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.404 HG21 ' O ' ' A' ' 46' ' ' THR . 64.7 t -66.22 -42.52 91.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.005 -176.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 24.9 m170 -64.73 -42.63 95.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.159 -178.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -66.12 -41.74 90.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.412 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 81.2 mt -63.05 -40.68 98.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.869 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.5 tptt -60.92 -40.84 94.73 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.103 0.478 . . . . 0.0 110.015 175.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.0 t -67.46 -20.08 65.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.907 178.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -81.11 5.76 15.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.232 178.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.04 12.62 58.72 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.58 177.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.548 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.5 mp -83.34 170.11 14.92 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.523 0.678 . . . . 0.0 111.804 179.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.43 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 16.8 m -117.71 164.28 15.22 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.78 -1.1 . . . . 0.0 108.562 173.036 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.08 -35.93 72.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.732 0.301 . . . . 0.0 111.685 -175.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.1 mp0 -69.07 -37.27 78.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.054 0.454 . . . . 0.0 110.703 -177.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.43 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 1.5 mm-40 -68.44 -44.34 75.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.505 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 75.9 mt -62.5 -41.58 92.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.438 179.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 49.7 t -56.71 -42.99 80.14 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.99 178.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.684 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 26.9 tt0 -68.27 -48.4 65.13 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.52 179.311 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.0 -44.69 78.88 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.277 -177.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.51 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.2 m-85 -57.73 -42.81 84.63 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.902 0.382 . . . . 0.0 111.123 177.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.1 m -66.69 -33.12 74.93 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.331 0.586 . . . . 0.0 110.588 -178.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.684 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 25.2 mtpp -71.87 -31.95 66.96 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.471 -178.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.537 HG13 ' HB2' ' A' ' 36' ' ' LEU . 11.7 m -82.7 -3.91 7.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.813 0.339 . . . . 0.0 111.08 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 101.73 16.46 24.04 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.8 177.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -123.92 91.39 49.69 Favored Pre-proline 0 C--N 1.322 -0.622 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -71.43 101.61 1.16 Allowed 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 122.033 1.822 . . . . 0.0 112.115 -176.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -108.37 147.93 30.84 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.489 177.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 43.1 p -85.47 162.43 18.96 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.001 175.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.4 tp -63.64 -33.17 75.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.265 0.555 . . . . 0.0 109.714 177.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -61.83 -42.36 98.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.55 178.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.429 ' O ' HG13 ' A' ' 82' ' ' ILE . 24.5 mm-40 -56.03 -49.6 73.24 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.593 177.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.7 mm -62.72 -49.69 82.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.965 -174.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -64.14 -39.29 93.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.892 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 18.3 tpp180 -64.28 -45.14 89.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.94 178.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 78' ' ' GLU . 96.8 mt -63.15 -34.11 64.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.847 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.7 mt -77.0 -20.8 55.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.255 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 47.3 m . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.885 -0.578 . . . . 0.0 110.481 -179.033 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm . . . . . 0 N--CA 1.48 1.034 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -80.89 165.33 19.81 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.424 2.083 . . . . 0.0 112.592 -178.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -92.26 16.15 12.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.537 0.684 . . . . 0.0 109.932 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 10.0 t -99.02 -6.84 9.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.336 -176.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -57.19 125.53 23.14 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 28.1 m80 65.93 99.4 0.04 OUTLIER 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 -170.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.3 p -59.89 172.23 0.79 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.841 -174.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -57.16 -44.45 83.48 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.051 -175.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.9 m -68.79 -32.8 72.79 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 121.242 -0.183 . . . . 0.0 111.22 -178.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.502 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 48.4 mt-10 -71.61 -47.92 51.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.942 0.401 . . . . 0.0 110.588 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.412 ' O ' HG21 ' A' ' 29' ' ' VAL . 18.7 ptp180 -68.87 -40.41 79.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.235 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -62.22 -43.02 99.77 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.242 -179.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -69.99 -34.3 73.16 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.925 -177.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.508 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 63.2 mtm180 -64.72 -48.37 74.87 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 120.922 0.392 . . . . 0.0 109.956 177.174 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.526 ' O ' HG21 ' A' ' 33' ' ' VAL . 86.0 t -60.7 -42.55 92.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.185 176.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.5 t -58.93 -45.9 89.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.028 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -61.26 -36.19 79.34 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.006 0.432 . . . . 0.0 110.668 178.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.32 -44.58 62.48 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.048 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.526 HG21 ' O ' ' A' ' 29' ' ' VAL . 92.7 t -60.96 -43.51 96.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.799 0.333 . . . . 0.0 110.536 -179.29 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -68.76 -34.5 75.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.982 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -72.94 -43.37 62.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.061 0.457 . . . . 0.0 110.711 178.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.514 ' HB2' HG12 ' A' ' 70' ' ' VAL . 84.2 mt -65.66 -29.44 70.0 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.602 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.4 HD21 ' HA ' ' A' ' 37' ' ' LEU . 15.5 mt -84.18 6.36 22.84 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.585 -177.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.496 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 22.9 t70 -83.57 136.76 34.13 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.874 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.1 t -53.8 -43.68 69.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.038 -177.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -68.55 -42.67 78.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.157 0.503 . . . . 0.0 110.396 -177.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.494 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 86.9 t -66.94 -34.54 70.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.034 -179.171 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 83.9 mtp180 -67.19 -22.94 65.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.247 177.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 57.8 ttp180 -84.3 -18.12 37.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.751 0.31 . . . . 0.0 110.936 -178.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -85.73 158.68 56.35 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.66 -0.246 . . . . 0.0 110.709 175.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.442 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 31.7 Cg_endo -65.43 157.04 60.21 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 122.671 2.247 . . . . 0.0 112.574 -179.472 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.443 ' O ' HG21 ' A' ' 50' ' ' VAL . 0.5 OUTLIER -60.37 -40.26 90.19 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.055 -177.411 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 11.0 m -58.12 -42.43 85.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.913 -177.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.414 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 56.4 m -62.75 -45.47 92.57 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.885 178.102 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.497 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 81.3 mttt -57.07 -49.37 76.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.996 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.443 HG21 ' O ' ' A' ' 46' ' ' THR . 99.6 t -64.77 -43.19 96.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.064 -176.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 29.0 m170 -64.45 -37.97 89.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.962 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.444 ' CE1' ' HE2' ' A' ' 56' ' ' LYS . 43.8 t80 -70.17 -42.77 72.02 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.514 -178.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 89.9 mt -64.0 -34.76 78.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.952 0.406 . . . . 0.0 110.801 178.558 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.437 ' HE3' ' HB3' ' A' ' 54' ' ' LYS . 0.5 OUTLIER -60.73 -43.5 97.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.336 175.199 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 45.8 m -69.79 -13.76 62.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.086 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.453 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 65.6 mttm -78.85 -8.18 58.58 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.315 174.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.4 20.72 28.99 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.047 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.508 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.7 mp -86.55 154.8 20.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.07 0.462 . . . . 0.0 111.254 178.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.493 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 13.1 m -93.84 161.87 14.15 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.19 174.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.24 -35.23 71.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.22 0.533 . . . . 0.0 110.875 -179.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -67.9 -38.89 83.54 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.527 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.493 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 4.2 mm-40 -65.89 -44.88 84.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.978 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 75.1 mt -62.04 -43.81 98.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.368 178.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 39.7 t -57.45 -44.17 84.54 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.753 176.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 70.1 tt0 -67.21 -47.28 71.33 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.838 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.45 -47.84 80.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.259 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.582 ' O ' HG21 ' A' ' 70' ' ' VAL . 6.2 m-85 -57.05 -44.54 83.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.988 0.423 . . . . 0.0 111.087 178.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.1 m -65.09 -32.77 74.64 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.996 0.427 . . . . 0.0 110.626 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 19.1 mtmt -71.27 -31.7 67.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.75 179.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.582 HG21 ' O ' ' A' ' 67' ' ' PHE . 11.0 m -82.29 -3.55 7.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-O 120.859 0.362 . . . . 0.0 111.439 -177.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 100.12 17.19 25.68 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.261 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -126.68 91.15 48.0 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 179.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -72.73 99.24 1.04 Allowed 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 121.706 1.604 . . . . 0.0 112.239 -176.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.42 ' HE3' HG21 ' A' ' 46' ' ' THR . 73.3 mmtt -107.59 137.37 45.74 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.193 175.447 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.429 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 76.7 p -80.69 159.41 25.29 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.398 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.416 ' O ' ' HG3' ' A' ' 80' ' ' LYS . 52.6 tp -61.42 -33.22 73.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.813 178.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -61.16 -43.58 98.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.917 178.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.429 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 21.6 mm-40 -59.13 -49.71 76.84 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.608 178.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 45.1 mm -62.66 -44.14 99.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.189 -174.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 76' ' ' LEU . 61.6 mttm -63.89 -38.62 91.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.807 0.337 . . . . 0.0 110.927 -179.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 18.3 tpt180 -67.73 -44.48 77.51 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.775 177.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 78' ' ' GLU . 90.7 mt -62.16 -37.82 79.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.874 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 81.4 mt -78.21 -25.85 47.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.551 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 C--O 1.252 1.191 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.691 -178.556 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm . . . . . 0 N--CA 1.478 0.953 0 CA-C-O 121.127 0.489 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -82.66 165.12 15.99 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 123.234 2.622 . . . . 0.0 112.819 -173.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -90.33 13.57 15.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.204 0.526 . . . . 0.0 111.129 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 23.3 t -77.26 -24.34 14.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.516 0.674 . . . . 0.0 109.54 177.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -69.71 150.38 47.02 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.77 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 39.8 m80 -92.03 83.67 5.19 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.023 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 20.5 p -81.96 -77.42 0.22 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.083 0.468 . . . . 0.0 110.727 -178.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 38.6 p-80 -73.57 -22.46 60.06 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.376 -179.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.5 t -61.64 -35.04 76.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.555 -179.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.44 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 12.8 mt-10 -68.75 -47.74 65.52 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.941 -0.303 . . . . 0.0 111.043 178.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.509 ' HB2' ' OE2' ' A' ' 62' ' ' GLU . 0.1 OUTLIER -69.67 -37.38 76.67 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.35 -179.546 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -60.81 -44.04 97.41 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.213 -179.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.415 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 21.5 pttp -67.76 -34.24 76.42 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.436 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.451 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 39.8 mtm180 -66.05 -47.03 75.7 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.762 0.315 . . . . 0.0 110.523 179.233 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.505 ' O ' HG22 ' A' ' 33' ' ' VAL . 82.3 t -61.26 -42.68 94.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.215 177.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 35.8 m -58.69 -46.44 87.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.801 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -61.67 -36.0 79.58 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.083 0.468 . . . . 0.0 111.069 179.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.62 -44.41 62.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.006 179.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.505 HG22 ' O ' ' A' ' 29' ' ' VAL . 75.6 t -60.82 -43.24 95.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.845 0.355 . . . . 0.0 110.575 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -69.22 -34.04 74.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.019 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -72.43 -43.52 63.71 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.885 0.374 . . . . 0.0 110.775 178.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.52 ' HB2' HG12 ' A' ' 70' ' ' VAL . 88.9 mt -66.51 -31.45 72.19 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.702 -177.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.6 mt -85.98 6.83 26.88 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.83 0.347 . . . . 0.0 111.918 -177.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.483 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 14.3 t70 -77.58 135.88 38.21 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 176.212 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.7 m -57.8 -36.17 71.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.74 0.305 . . . . 0.0 111.698 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -69.21 -41.56 76.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.196 0.522 . . . . 0.0 110.612 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.482 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 88.8 t -72.37 -32.93 44.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.876 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 24.6 mtp180 -66.08 -21.62 66.38 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.577 175.422 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -80.99 -17.88 48.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.132 -177.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -92.02 158.72 39.13 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.132 178.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.408 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 32.8 Cg_endo -64.82 156.9 59.27 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.885 2.39 . . . . 0.0 112.347 178.318 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.437 HG21 ' HE3' ' A' ' 74' ' ' LYS . 1.1 m -65.7 -38.08 88.23 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.599 -174.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.3 m -58.69 -38.43 78.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.951 0.405 . . . . 0.0 110.731 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 75.5 m -65.88 -44.25 85.92 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.827 176.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.482 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 86.8 mttt -57.27 -47.74 80.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.546 178.322 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 46' ' ' THR . 82.3 t -63.87 -46.1 95.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.167 -177.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -64.16 -37.21 86.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.983 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -64.08 -47.23 80.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.463 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 96.2 mt -64.04 -37.07 86.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.942 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -59.29 -43.26 92.57 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.13 0.49 . . . . 0.0 110.436 176.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.4 m -70.52 -16.6 62.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.505 -179.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.4 mmtp -85.41 -4.32 59.12 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 120.781 0.324 . . . . 0.0 111.199 177.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.81 13.71 31.27 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.73 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.451 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.0 mp -87.31 149.88 24.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.189 0.518 . . . . 0.0 111.709 178.059 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.429 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 16.8 m -94.04 167.63 11.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.519 175.44 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.73 -38.16 80.92 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -177.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -65.89 -37.51 86.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.112 0.482 . . . . 0.0 110.406 -179.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.509 ' OE2' ' HB2' ' A' ' 25' ' ' ARG . 3.1 mm-40 -64.46 -47.45 78.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.682 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.76 -45.47 98.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.627 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 53.7 t -58.13 -44.71 87.95 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.168 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.629 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 29.9 tt0 -67.48 -48.32 67.48 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.663 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.65 -44.02 80.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.458 -178.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.564 ' O ' HG23 ' A' ' 70' ' ' VAL . 3.4 m-85 -58.53 -41.85 86.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.974 0.416 . . . . 0.0 111.207 179.057 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.8 m -65.77 -34.22 77.67 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.233 0.539 . . . . 0.0 110.422 -177.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.629 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 4.4 mtpm? -71.46 -31.2 66.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.957 179.249 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 67' ' ' PHE . 11.0 m -83.48 4.13 2.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.811 0.338 . . . . 0.0 111.23 -178.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 94.02 17.45 40.6 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.606 176.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -127.1 91.55 46.42 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -70.28 98.26 0.73 Allowed 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 121.748 1.632 . . . . 0.0 112.328 -177.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.437 ' HE3' HG21 ' A' ' 46' ' ' THR . 71.6 mmtt -106.61 140.19 39.87 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.799 177.653 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 30.6 p -86.06 156.57 20.35 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.26 178.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 37.5 tp -62.42 -32.3 73.12 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -56.81 -45.48 82.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.501 176.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.425 ' O ' HG13 ' A' ' 82' ' ' ILE . 33.0 mt-10 -61.79 -48.76 79.18 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.71 177.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 46.4 mm -60.29 -46.27 95.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.839 -176.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -63.02 -38.06 89.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.948 178.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.1 tpp180 -67.9 -44.15 77.64 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.697 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.425 HG13 ' O ' ' A' ' 78' ' ' GLU . 93.6 mt -64.67 -36.49 77.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.845 -179.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.7 mt -78.98 -25.27 43.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.328 178.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 C--O 1.252 1.203 0 CA-C-O 119.053 -0.499 . . . . 0.0 110.578 -176.903 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 110.143 -0.318 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -65.09 115.37 3.26 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.204 1.936 . . . . 0.0 111.122 173.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -95.43 26.89 3.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.233 0.54 . . . . 0.0 111.215 -177.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.5 p -78.87 -10.73 12.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.95 0.881 . . . . 0.0 109.298 170.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -84.85 152.18 23.77 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.048 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 39.2 m80 70.95 153.59 0.12 Allowed 'General case' 0 N--CA 1.466 0.337 0 O-C-N 123.814 0.696 . . . . 0.0 111.144 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.6 p -80.83 83.6 6.54 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.372 0.606 . . . . 0.0 110.8 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.42 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . 22.6 p80 -71.15 -21.83 62.13 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.652 -178.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.9 p -63.86 -43.91 94.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.011 0.434 . . . . 0.0 110.393 175.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.484 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 64.2 mt-10 -68.17 -40.86 82.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.774 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.606 ' HB2' ' OE2' ' A' ' 62' ' ' GLU . 7.8 ptm180 -69.18 -38.95 78.95 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.211 178.091 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -63.52 -44.06 95.35 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.012 -178.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -63.78 -32.1 73.49 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.6 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.484 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 35.2 mtm180 -67.21 -44.5 79.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.402 177.444 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.609 ' O ' HG22 ' A' ' 33' ' ' VAL . 87.5 t -61.1 -46.84 95.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.156 177.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.1 m -62.4 -43.77 98.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.343 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -61.78 -36.04 79.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.124 0.488 . . . . 0.0 110.537 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.461 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -69.94 -43.89 70.69 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.584 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.609 HG22 ' O ' ' A' ' 29' ' ' VAL . 90.3 t -60.32 -46.23 95.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.011 0.434 . . . . 0.0 110.393 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.89 -33.7 74.2 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.26 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -72.1 -43.7 64.37 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.787 0.327 . . . . 0.0 110.789 177.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.529 ' HB2' HG11 ' A' ' 70' ' ' VAL . 95.1 mt -65.02 -31.3 72.46 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.213 -179.058 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.5 mt -85.84 5.84 30.9 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.991 -177.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.604 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 10.6 t70 -74.28 134.0 42.62 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 177.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 m -52.15 -36.7 52.24 Favored 'General case' 0 C--N 1.328 -0.365 0 O-C-N 123.386 0.428 . . . . 0.0 111.652 -176.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 84.5 mtm180 -68.86 -44.42 73.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.181 0.515 . . . . 0.0 110.978 178.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.52 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.3 t -70.96 -26.69 28.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.681 -176.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.604 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 52.1 mtt180 -62.39 -22.49 66.19 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.421 174.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -90.27 -18.4 25.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.73 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.1 p -81.57 152.71 70.21 Favored Pre-proline 0 C--N 1.326 -0.433 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.63 177.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.4 ' HG2' ' OG ' ' A' ' 48' ' ' SER . 26.4 Cg_endo -63.8 154.53 69.06 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.309 2.006 . . . . 0.0 111.912 177.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.411 ' O ' HG23 ' A' ' 50' ' ' VAL . 1.5 m -59.5 -39.54 84.16 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.249 -177.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.403 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 13.8 m -58.26 -42.26 86.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.843 -179.038 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.4 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 74.4 m -62.47 -44.27 96.81 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.152 178.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.52 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 84.7 mttt -57.65 -49.97 74.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.26 179.345 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 46' ' ' THR . 61.6 t -64.69 -40.96 90.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.113 -176.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 36.7 m170 -64.92 -38.37 90.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.903 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -64.68 -47.0 80.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.885 0.374 . . . . 0.0 110.359 179.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.473 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 90.1 mt -62.59 -37.68 87.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.134 -179.076 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.473 ' HD3' HD22 ' A' ' 83' ' ' LEU . 38.3 ttpt -60.74 -42.19 96.85 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.313 0.578 . . . . 0.0 110.029 175.048 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.6 t -63.19 -24.77 68.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.811 178.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -85.1 7.21 22.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.391 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.8 7.94 70.43 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.623 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.478 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.4 mp -75.85 147.74 38.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.349 0.595 . . . . 0.0 111.125 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.498 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 14.9 m -91.2 162.9 14.45 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.786 174.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.01 -35.93 71.95 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.99 0.424 . . . . 0.0 111.14 -177.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -63.91 -41.61 97.62 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.247 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.606 ' OE2' ' HB2' ' A' ' 25' ' ' ARG . 3.1 mm-40 -63.63 -45.63 89.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.422 0.63 . . . . 0.0 109.543 -178.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 63.2 mt -62.99 -43.65 99.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.709 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 40.3 t -56.59 -46.18 80.96 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.139 178.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -68.01 -47.68 67.79 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.698 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.404 ' O ' HG12 ' A' ' 70' ' ' VAL . . . -56.92 -46.31 82.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.902 -179.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.57 ' O ' HG22 ' A' ' 70' ' ' VAL . 2.6 m-85 -57.21 -45.72 83.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.247 179.316 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.9 m -65.25 -33.46 76.04 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.436 -177.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.439 ' HE3' HG21 ' A' ' 33' ' ' VAL . 25.9 mtmt -72.63 -27.04 61.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.996 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.57 HG22 ' O ' ' A' ' 67' ' ' PHE . 8.6 m -87.05 3.45 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-O 120.841 0.353 . . . . 0.0 111.217 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 94.56 15.77 45.4 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.571 -0.824 . . . . 0.0 112.623 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -124.17 91.58 49.39 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -71.71 99.79 0.99 Allowed 'Trans proline' 0 N--CA 1.455 -0.758 0 C-N-CA 121.997 1.798 . . . . 0.0 112.332 -176.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -113.12 140.94 47.47 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.922 176.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 33.2 p -82.93 167.91 17.54 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.596 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 60.5 tp -63.0 -33.86 76.32 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 174.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -62.23 -43.63 98.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.458 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -57.06 -48.58 78.22 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.818 178.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.9 mm -61.33 -48.88 86.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.825 -176.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -64.64 -35.38 80.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.846 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.8 tpt180 -61.98 -45.77 92.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.247 0.546 . . . . 0.0 110.348 175.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.403 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 78.4 mt -68.1 -33.96 63.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.172 -178.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.473 HD22 ' HD3' ' A' ' 54' ' ' LYS . 87.5 mt -81.79 -20.68 38.66 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.906 178.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 71.5 m . . . . . 0 C--O 1.252 1.223 0 CA-C-O 117.963 -1.018 . . . . 0.0 111.684 179.236 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -74.91 115.19 4.21 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.371 2.047 . . . . 0.0 111.793 176.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -139.19 80.99 1.81 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.259 0.552 . . . . 0.0 110.394 -179.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 25.0 t -101.61 -31.63 3.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.244 176.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -70.09 153.47 43.13 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.805 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 10.9 p-80 -105.83 66.78 0.73 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.406 0.622 . . . . 0.0 110.167 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.2 m -66.35 -29.98 70.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.474 -175.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -67.53 -43.72 80.11 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 177.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.6 m -64.19 -34.33 77.84 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.37 177.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 66.7 mm-40 -64.8 -47.28 78.64 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.527 178.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.0 ptm180 -69.79 -37.09 76.19 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.387 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -64.67 -42.99 94.98 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.477 -179.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -67.16 -32.31 73.33 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 121.036 -0.265 . . . . 0.0 110.546 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 37.5 mtm-85 -68.45 -41.24 80.55 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 177.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.567 ' O ' HG21 ' A' ' 33' ' ' VAL . 69.2 t -60.91 -44.87 98.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.303 -0.408 . . . . 0.0 109.994 174.308 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.1 m -58.77 -42.2 88.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.021 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.489 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 23.3 m-80 -66.48 -34.76 78.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.051 0.453 . . . . 0.0 110.994 177.153 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.59 -43.99 65.27 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.108 177.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.567 HG21 ' O ' ' A' ' 29' ' ' VAL . 94.4 t -61.25 -40.93 87.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.847 0.356 . . . . 0.0 110.752 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.489 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 12.3 pt-20 -68.94 -37.49 78.91 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.563 178.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -72.28 -43.53 64.12 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.161 -179.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.546 ' HB2' HG13 ' A' ' 70' ' ' VAL . 74.0 mt -65.1 -31.68 73.0 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.45 -179.165 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.3 mt -85.79 6.48 27.79 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -176.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -76.87 139.05 40.13 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 177.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.9 t -59.45 -31.78 69.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.85 0.357 . . . . 0.0 111.057 -178.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -68.53 -42.69 78.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.372 0.606 . . . . 0.0 110.549 178.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 93.6 t -79.52 -32.26 14.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.271 -171.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -67.92 -22.2 65.08 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.118 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -83.98 -18.09 38.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.72 0.295 . . . . 0.0 111.496 -178.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.09 162.93 50.35 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 116.638 -0.256 . . . . 0.0 110.756 177.231 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -63.97 157.9 50.33 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.626 2.217 . . . . 0.0 112.376 179.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.69 -35.18 78.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.075 -178.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.546 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 14.6 p -58.73 -43.66 90.26 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.402 -178.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.3 m -61.12 -45.93 92.68 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.965 178.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.454 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 82.0 mttt -57.34 -50.3 73.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.564 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 92.1 t -65.57 -44.91 93.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.201 -174.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 27.3 m170 -64.48 -35.99 82.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.005 -177.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -70.19 -38.53 75.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.277 -178.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 82.5 mt -69.83 -37.62 76.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.699 178.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -62.56 -38.26 89.34 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.162 0.506 . . . . 0.0 109.851 174.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.5 t -67.1 -19.96 65.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.441 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 69.0 mmtt -80.81 -8.37 59.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.768 177.232 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.07 15.67 38.08 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.601 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.9 mp -80.94 145.56 31.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.104 0.478 . . . . 0.0 111.402 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.2 m -82.28 163.46 21.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.539 173.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.73 -41.1 85.63 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.843 0.354 . . . . 0.0 111.246 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -70.55 -30.37 67.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.393 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -66.97 -45.73 76.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.225 0.535 . . . . 0.0 109.941 175.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 64.7 mt -62.67 -43.09 98.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.232 177.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 43.9 t -56.76 -43.62 80.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.836 176.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.98 -48.56 65.46 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.824 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.1 -42.62 81.09 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.281 -179.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.463 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.3 m-85 -60.8 -47.57 85.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.917 177.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 21.8 m -64.07 -34.96 79.21 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.04 0.448 . . . . 0.0 110.255 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mmmt -62.79 -35.39 79.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.602 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.546 HG13 ' HB2' ' A' ' 36' ' ' LEU . 22.4 m -87.42 7.23 2.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -176.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.6 18.39 48.64 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.657 177.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -123.75 90.97 50.18 Favored Pre-proline 0 C--N 1.322 -0.613 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 177.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -71.92 97.71 0.84 Allowed 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 121.903 1.736 . . . . 0.0 112.437 -176.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -106.97 137.96 44.06 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.848 176.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.7 p -80.64 162.05 24.4 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.409 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 64.7 tp -61.42 -33.61 74.0 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 175.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -60.18 -44.32 95.14 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.365 176.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.444 ' O ' HG13 ' A' ' 82' ' ' ILE . 8.7 mm-40 -61.21 -47.3 86.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.125 177.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.8 mm -60.13 -47.44 91.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.888 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -62.42 -40.85 97.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.13 0.491 . . . . 0.0 110.548 177.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -59.89 -47.02 87.45 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.747 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.546 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 88.8 mt -66.72 -31.64 54.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.09 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.1 mt -77.73 -12.57 59.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.204 178.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 25.9 p . . . . . 0 C--O 1.252 1.187 0 CA-C-O 119.036 -0.507 . . . . 0.0 110.577 177.305 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.9 pttp . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -74.97 140.18 25.24 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.016 1.81 . . . . 0.0 111.399 175.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -85.73 81.05 8.76 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.516 0.674 . . . . 0.0 109.762 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 40.8 t -81.99 -32.28 11.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.221 -178.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -98.97 154.74 17.84 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.287 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 42.7 p-80 -122.51 40.01 3.78 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 178.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.7 m -54.47 -31.97 56.83 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.307 -0.861 . . . . 0.0 112.314 -175.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.9 m170 -67.2 -40.6 86.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.216 0.531 . . . . 0.0 109.682 177.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 m -70.67 -29.88 66.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.024 177.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.6 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 61.9 mm-40 -65.63 -46.77 78.0 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.691 175.316 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.591 ' HB2' ' OE2' ' A' ' 62' ' ' GLU . 0.2 OUTLIER -67.99 -37.62 81.71 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.858 178.591 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.527 ' N ' ' HG3' ' A' ' 25' ' ' ARG . 35.2 tt0 -60.75 -44.05 97.18 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.551 -178.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 22.0 ptmt -68.28 -33.51 74.48 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.358 -179.457 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.6 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 34.8 mtm180 -63.19 -46.31 87.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 0.0 110.506 178.149 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.574 ' O ' HG23 ' A' ' 33' ' ' VAL . 97.9 t -61.74 -46.76 95.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.589 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.1 p -62.0 -38.51 88.88 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.247 -0.181 . . . . 0.0 111.428 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -61.15 -41.14 96.21 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.23 0.538 . . . . 0.0 110.37 176.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.69 -44.84 63.52 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.117 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 29' ' ' VAL . 87.0 t -61.49 -42.14 92.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.745 -179.225 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -69.23 -36.13 76.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.644 0.259 . . . . 0.0 110.829 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -71.97 -43.8 64.58 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.875 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.53 ' HB2' HG12 ' A' ' 70' ' ' VAL . 86.9 mt -65.74 -29.98 70.57 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.538 -178.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.435 ' HG ' ' CG1' ' A' ' 70' ' ' VAL . 12.2 mt -85.13 6.32 26.11 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -176.204 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.497 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 25.6 t70 -79.51 138.71 37.62 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.348 177.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.427 ' O ' ' HG2' ' A' ' 43' ' ' ARG . 23.1 m -57.04 -41.57 78.87 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -176.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.9 mmp_? -68.71 -38.55 80.34 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.087 0.47 . . . . 0.0 110.206 179.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.9 t -71.64 -25.15 24.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.387 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 71.0 mtp180 -72.75 -20.53 61.17 Favored 'General case' 0 C--N 1.319 -0.738 0 O-C-N 122.051 -0.406 . . . . 0.0 110.895 172.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.427 ' HG2' ' O ' ' A' ' 39' ' ' SER . 32.4 mmm180 -96.18 10.73 36.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.738 -177.596 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.487 ' C ' ' HZ3' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -110.12 168.08 8.15 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.677 178.249 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.41 ' HD2' HG22 ' A' ' 44' ' ' THR . 57.9 Cg_endo -70.73 156.26 61.14 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.425 2.083 . . . . 0.0 111.71 175.332 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.412 HG22 ' HE3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -67.21 -34.01 76.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.898 0.38 . . . . 0.0 111.067 -177.138 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.478 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 11.5 p -58.39 -42.16 86.49 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.513 -176.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.9 m -61.6 -42.33 98.71 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.877 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.487 ' HZ3' ' C ' ' A' ' 44' ' ' THR . 21.1 mttm -63.97 -47.41 80.5 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.654 -178.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 68.5 t -63.82 -44.41 98.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.743 -175.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -65.11 -40.52 94.64 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.743 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -62.53 -47.36 84.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.586 178.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 89.9 mt -64.58 -36.47 84.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.982 -178.624 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -64.3 -38.12 89.91 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 120.929 0.395 . . . . 0.0 110.241 176.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.2 t -66.68 -25.19 66.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.058 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.7 mmtt -78.12 -4.29 46.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.078 178.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.8 8.46 54.26 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.457 178.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.447 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.8 mp -80.43 146.62 31.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.454 0.645 . . . . 0.0 111.333 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.3 m -89.41 165.74 14.16 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.328 175.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.0 -37.27 76.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.962 0.41 . . . . 0.0 110.958 -178.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -64.13 -42.5 96.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.708 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.591 ' OE2' ' HB2' ' A' ' 25' ' ' ARG . 4.8 mm-40 -64.11 -44.81 91.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.38 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 77.2 mt -61.51 -42.89 95.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.299 178.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 43.5 t -57.88 -46.0 85.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.967 177.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -68.11 -45.11 74.6 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.247 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.44 -41.74 81.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.61 0.243 . . . . 0.0 111.207 -178.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.468 ' O ' HG22 ' A' ' 70' ' ' VAL . 8.9 m-85 -61.48 -46.33 90.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.052 0.453 . . . . 0.0 110.595 176.247 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 20.2 m -63.25 -32.84 74.35 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.089 0.471 . . . . 0.0 110.402 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 12.7 mmmt -66.74 -33.37 75.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.882 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.53 HG12 ' HB2' ' A' ' 36' ' ' LEU . 22.0 m -87.22 -0.17 7.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.729 0.299 . . . . 0.0 111.632 -177.428 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 99.27 16.29 30.29 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.579 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -122.86 91.43 49.73 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 178.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -70.84 100.57 0.96 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 121.786 1.657 . . . . 0.0 112.125 -177.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.412 ' HE3' HG22 ' A' ' 46' ' ' THR . 67.5 mmtt -105.22 142.6 34.71 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.679 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 41.6 p -83.12 156.01 23.51 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.289 178.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.87 -32.56 73.83 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 177.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.5 t30 -58.28 -45.78 87.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.748 177.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -59.3 -46.68 87.91 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.189 179.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 41.6 mm -60.3 -45.47 96.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.524 -177.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -64.29 -39.85 94.77 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.015 0.436 . . . . 0.0 110.858 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 64.5 ttt180 -60.11 -46.56 89.21 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.548 177.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.478 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 89.8 mt -67.35 -31.94 55.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.305 -0.862 . . . . 0.0 111.298 -179.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.4 mt -83.14 -14.25 53.95 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.332 179.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 21.8 p . . . . . 0 C--O 1.25 1.103 0 C-N-CA 123.653 0.781 . . . . 0.0 111.76 -179.242 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt . . . . . 0 N--CA 1.478 0.942 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -70.63 155.7 62.56 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.458 2.105 . . . . 0.0 111.494 175.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -147.39 100.7 3.29 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 7.8 p -129.81 -16.01 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.168 -176.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.46 119.67 10.19 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 120.795 0.331 . . . . 0.0 110.347 -179.369 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 12.2 t60 -88.9 -72.93 0.52 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.185 -0.462 . . . . 0.0 109.912 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.2 m -148.01 17.01 1.09 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.189 0.518 . . . . 0.0 110.691 178.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 49.9 m-70 -69.95 -44.09 70.23 Favored 'General case' 0 CA--C 1.519 -0.237 0 O-C-N 122.118 -0.363 . . . . 0.0 110.738 -176.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -70.17 -33.07 71.31 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -176.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.427 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 9.2 tp10 -64.45 -48.29 75.82 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.043 177.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -67.06 -47.41 71.4 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.395 178.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -58.02 -43.86 86.99 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.498 -176.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.9 pttm -71.78 -33.82 68.91 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.953 -177.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 25.0 mtm180 -67.64 -48.1 67.69 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.772 0.32 . . . . 0.0 110.398 178.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.572 ' O ' HG23 ' A' ' 33' ' ' VAL . 98.3 t -60.94 -39.95 83.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.821 176.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.8 t -58.37 -45.45 88.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.502 178.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.418 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 93.3 m-20 -62.59 -37.74 87.43 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.733 178.564 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.66 -45.04 63.17 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.414 -179.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' ' 29' ' ' VAL . 93.1 t -61.16 -41.91 91.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.87 0.367 . . . . 0.0 110.654 -178.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 10.4 pt-20 -68.93 -37.5 78.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.713 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -71.6 -43.01 67.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.936 0.398 . . . . 0.0 110.841 -179.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.52 ' HB2' HG13 ' A' ' 70' ' ' VAL . 84.0 mt -65.01 -30.39 71.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.577 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.3 mt -85.18 7.03 23.32 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -176.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.496 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 11.3 t70 -80.12 135.95 36.42 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 176.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.454 ' O ' ' HG3' ' A' ' 43' ' ' ARG . 15.4 p -57.12 -36.95 71.27 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.871 0.367 . . . . 0.0 111.48 -176.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 80.7 mtm180 -68.58 -38.96 81.11 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.273 0.559 . . . . 0.0 110.262 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 57.9 t -78.5 -25.03 13.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.228 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 79.7 mtp180 -72.69 -33.12 66.27 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.72 -0.392 . . . . 0.0 112.043 178.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.454 ' HG3' ' O ' ' A' ' 39' ' ' SER . 77.1 mtp180 -81.32 -10.25 59.6 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -173.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.482 ' C ' ' HZ1' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -79.41 173.54 7.56 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.76 -0.2 . . . . 0.0 110.632 177.087 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.437 ' HD2' HG21 ' A' ' 44' ' ' THR . 46.4 Cg_endo -68.62 155.65 68.19 Favored 'Trans proline' 0 C--O 1.239 0.54 0 C-N-CA 121.941 1.761 . . . . 0.0 111.249 171.003 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.37 -33.69 74.72 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.812 0.339 . . . . 0.0 111.019 -177.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.447 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 15.4 p -57.78 -42.64 84.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.259 -176.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.1 m -62.1 -43.82 97.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.111 -179.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.482 ' HZ1' ' C ' ' A' ' 44' ' ' THR . 17.2 mttm -62.05 -47.43 84.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.476 -177.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 76.6 t -64.53 -43.52 96.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.73 -177.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 37.8 m170 -64.87 -37.71 88.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.504 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -63.86 -51.24 65.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.436 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.407 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 91.6 mt -62.24 -36.28 81.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.063 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.19 -43.42 95.92 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.23 0.538 . . . . 0.0 110.309 176.566 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.2 t -70.68 -14.21 62.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.238 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -86.73 0.75 54.11 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.843 0.354 . . . . 0.0 110.925 177.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.65 10.32 50.49 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.475 177.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.425 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.8 mp -88.56 148.02 24.31 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.372 0.606 . . . . 0.0 111.119 178.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.405 ' O ' HG13 ' A' ' 63' ' ' ILE . 50.9 m -95.28 173.13 7.7 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.942 -1.027 . . . . 0.0 109.771 176.085 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.83 87.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.924 0.392 . . . . 0.0 111.313 -177.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -67.58 -35.51 79.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.261 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -64.17 -45.98 86.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.459 0.647 . . . . 0.0 109.51 178.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 59' ' ' SER . 64.4 mt -65.19 -43.65 95.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.816 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 53.2 t -57.36 -43.22 83.32 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.915 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.47 -48.62 66.65 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.762 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.2 -47.62 80.81 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.198 -178.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.544 ' O ' HG22 ' A' ' 70' ' ' VAL . 5.1 m-85 -56.93 -45.83 82.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.278 179.115 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.6 m -64.91 -33.14 75.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.965 0.412 . . . . 0.0 110.584 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.1 mtmt -70.56 -31.62 68.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.973 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.544 HG22 ' O ' ' A' ' 67' ' ' PHE . 14.3 m -83.68 -3.78 7.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.836 0.35 . . . . 0.0 111.457 -176.75 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 101.14 18.49 19.48 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.339 178.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -126.87 91.39 47.21 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 177.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -72.87 101.72 1.35 Allowed 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 121.711 1.608 . . . . 0.0 112.281 -176.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -111.26 140.51 45.76 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.64 175.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 47.3 p -81.92 165.52 20.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.956 0.408 . . . . 0.0 110.474 177.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.4 -33.02 74.64 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.784 177.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -63.49 -42.15 98.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.076 178.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.509 ' O ' HG13 ' A' ' 82' ' ' ILE . 2.7 mm-40 -58.14 -48.19 81.01 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.829 177.002 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 42.3 mm -62.69 -42.11 94.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.468 -178.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -61.96 -43.69 98.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.974 0.416 . . . . 0.0 110.572 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 27.2 tpt180 -60.67 -45.89 92.43 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.353 -0.839 . . . . 0.0 111.078 178.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.509 HG13 ' O ' ' A' ' 78' ' ' GLU . 82.8 mt -67.91 -35.6 72.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.102 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 71.5 mt -77.8 -13.4 59.9 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 -179.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 20.8 p . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.474 -0.774 . . . . 0.0 109.975 175.675 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.4 tptm . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -76.68 91.82 1.13 Allowed 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.27 1.98 . . . . 0.0 111.738 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.416 ' CG ' ' HA ' ' A' ' 21' ' ' THR . 41.3 tt0 -97.72 93.71 6.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.138 0.494 . . . . 0.0 111.328 -176.761 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.5 t -111.29 -55.85 4.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 171.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.442 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -109.16 -19.55 13.3 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.718 -1.128 . . . . 0.0 110.221 179.045 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 60.4 m80 -85.3 28.17 0.75 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.598 -178.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.442 ' HB ' ' HG2' ' A' ' 24' ' ' GLU . 19.5 m -56.63 133.96 54.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.701 179.218 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -63.97 -35.06 79.44 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.888 0.375 . . . . 0.0 110.015 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.7 m -60.09 -34.04 72.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.35 175.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.564 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 35.6 mm-40 -65.35 -47.84 75.04 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.898 179.06 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.463 ' HG3' ' N ' ' A' ' 26' ' ' GLU . 8.2 ptm180 -66.54 -37.25 84.6 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.703 179.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.463 ' N ' ' HG3' ' A' ' 25' ' ' ARG . 40.9 tt0 -62.06 -45.09 95.07 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.764 -179.231 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.424 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 13.7 ptmm? -73.01 -34.96 66.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.861 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.564 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 28.2 mtm180 -66.51 -41.11 89.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.502 0.191 . . . . 0.0 110.772 178.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.442 HG21 ' O ' ' A' ' 25' ' ' ARG . 70.6 t -63.09 -41.96 94.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 175.491 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.4 m -58.6 -46.96 85.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.262 176.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -62.37 -38.41 89.46 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.142 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.431 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -70.43 -45.34 66.05 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.168 -177.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.418 HG21 ' O ' ' A' ' 29' ' ' VAL . 71.3 t -61.5 -44.68 98.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.877 0.37 . . . . 0.0 110.454 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -69.43 -33.66 73.29 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.924 -179.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -71.4 -43.07 67.51 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.953 0.406 . . . . 0.0 110.388 179.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.535 ' HB2' HG13 ' A' ' 70' ' ' VAL . 90.4 mt -64.27 -29.22 70.32 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.27 178.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.4 mt -85.35 6.5 26.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.168 -0.469 . . . . 0.0 112.084 -178.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -82.13 139.0 34.62 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.214 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.481 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 25.1 t -58.21 -37.4 74.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.628 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -68.18 -37.03 80.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.16 0.505 . . . . 0.0 110.438 -179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.56 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.0 t -79.33 -34.21 16.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.34 -176.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.481 ' HG2' ' O ' ' A' ' 39' ' ' SER . 39.6 ptt180 -68.26 -22.21 64.77 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.79 0.329 . . . . 0.0 110.543 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.2 ttp180 -84.75 -19.22 33.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.867 -178.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.22 161.35 49.44 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.92 178.336 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.402 ' HG2' ' OG ' ' A' ' 48' ' ' SER . 32.6 Cg_endo -63.53 155.99 59.43 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.687 2.258 . . . . 0.0 112.264 177.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.69 -38.28 87.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.291 -177.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.8 m -58.76 -41.13 85.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.01 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.402 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 62.2 m -61.77 -45.99 91.51 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.801 178.393 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.56 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 80.1 mttt -56.91 -49.18 76.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.241 178.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 84.5 t -63.23 -45.28 98.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.143 -177.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 39.8 m170 -64.83 -37.24 86.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.964 -178.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -66.71 -45.99 76.98 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.691 0.281 . . . . 0.0 110.349 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 88.1 mt -62.23 -37.4 85.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.69 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.2 tppt? -59.79 -42.55 93.62 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.152 174.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.6 m -67.51 -15.32 63.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.973 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 27.6 mmtp -86.77 -4.6 59.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.901 177.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.15 7.68 55.93 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.858 -0.686 . . . . 0.0 112.753 178.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.43 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 5.1 mp -73.13 150.4 42.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.368 0.604 . . . . 0.0 111.602 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.6 m -90.88 161.28 15.29 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.362 -0.835 . . . . 0.0 108.78 173.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.27 -38.71 77.51 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.989 0.424 . . . . 0.0 110.498 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.406 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 1.8 mp0 -59.64 -43.16 93.95 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.716 177.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.11 -43.66 77.9 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.77 -178.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 74.7 mt -60.78 -44.34 97.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.079 176.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 52.9 t -59.37 -43.94 92.8 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.721 178.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.695 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 30.3 tt0 -67.53 -48.99 65.43 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.879 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.65 -45.24 81.74 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 120.54 0.21 . . . . 0.0 111.047 -178.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.546 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.7 m-85 -57.04 -44.95 83.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.927 0.394 . . . . 0.0 111.055 177.448 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.8 m -65.14 -33.14 75.32 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.251 0.548 . . . . 0.0 110.485 -177.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.695 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 20.7 mtpp -71.65 -32.34 67.82 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.797 -179.21 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.546 HG22 ' O ' ' A' ' 67' ' ' PHE . 15.2 m -81.9 -4.41 7.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 121.049 -0.261 . . . . 0.0 111.314 -177.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 102.04 16.66 22.84 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.407 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.413 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 5.6 tp-100 -126.79 90.93 48.43 Favored Pre-proline 0 C--N 1.323 -0.587 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -74.02 99.43 1.17 Allowed 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 121.974 1.783 . . . . 0.0 112.268 -176.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -106.46 138.08 43.29 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.557 175.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.414 ' O ' HG12 ' A' ' 79' ' ' ILE . 63.7 p -77.32 156.31 31.41 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.26 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 37.8 tp -62.94 -32.69 74.06 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -60.79 -46.08 91.88 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.626 175.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -60.44 -43.76 96.48 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.383 178.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 75' ' ' THR . 45.7 mm -60.35 -43.25 93.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.533 0.206 . . . . 0.0 110.684 -178.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -63.98 -41.35 97.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.295 0.569 . . . . 0.0 110.649 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -59.8 -42.45 93.44 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.825 177.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 79.8 mt -73.91 -32.69 34.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.288 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 64.3 mt -80.92 -1.97 45.7 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.248 1.011 0 CA-C-O 119.144 -0.455 . . . . 0.0 110.485 175.857 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.415 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 49.5 mttp . . . . . 0 N--CA 1.476 0.873 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.11 102.94 0.22 Allowed 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 121.988 1.792 . . . . 0.0 110.185 167.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 15' ' ' LYS . 78.7 mm-40 -89.56 8.41 31.37 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -167.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.6 t -104.38 -56.08 5.31 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-O 121.182 0.515 . . . . 0.0 110.589 -179.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -102.57 -27.5 12.72 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.985 -178.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 65.82 -79.81 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 O-C-N 123.85 0.719 . . . . 0.0 111.417 -179.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.5 m -91.43 94.05 9.29 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.208 0.528 . . . . 0.0 110.852 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.477 ' O ' ' HG2' ' A' ' 25' ' ' ARG . 37.7 m80 -66.19 -32.26 73.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.441 177.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -60.96 -33.78 73.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.935 0.398 . . . . 0.0 110.361 178.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.562 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 36.7 tt0 -68.88 -45.11 71.85 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.44 -179.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' A' ' 22' ' ' HIS . 25.0 ptt180 -67.56 -37.31 82.47 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.664 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -60.5 -44.86 95.54 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.258 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -71.44 -32.95 68.93 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.201 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.562 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 31.9 mtm180 -65.9 -44.22 85.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.746 -0.206 . . . . 0.0 110.65 177.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.565 ' O ' HG22 ' A' ' 33' ' ' VAL . 94.5 t -60.75 -44.56 97.6 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.159 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 174.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 29.6 m -58.71 -44.17 90.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.749 178.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -62.77 -37.07 85.17 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.169 0.509 . . . . 0.0 110.763 177.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.03 -44.41 63.44 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.914 -178.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 29' ' ' VAL . 92.9 t -61.38 -42.9 95.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.458 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.5 -36.79 76.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.662 0.268 . . . . 0.0 110.938 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -71.48 -42.95 67.43 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.945 0.402 . . . . 0.0 110.636 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.508 ' HB2' HG13 ' A' ' 70' ' ' VAL . 80.6 mt -66.97 -30.75 70.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.196 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.412 ' HG ' ' CG1' ' A' ' 70' ' ' VAL . 12.6 mt -85.38 7.49 22.3 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.628 -178.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -81.16 137.98 35.89 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.058 175.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.421 ' HA ' ' HG2' ' A' ' 42' ' ' ARG . 15.8 m -61.53 -36.45 80.61 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.773 -176.366 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -70.33 -39.38 74.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.225 0.535 . . . . 0.0 109.66 -179.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.469 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 91.3 t -76.36 -36.78 30.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.603 -177.589 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.421 ' HG2' ' HA ' ' A' ' 39' ' ' SER . 40.2 ptt180 -65.91 -20.18 66.13 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 121.937 -0.477 . . . . 0.0 109.792 176.685 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 28.2 tpt180 -83.07 -19.03 37.61 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.545 179.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 p -82.4 161.18 60.31 Favored Pre-proline 0 C--N 1.33 -0.241 0 O-C-N 122.144 -0.347 . . . . 0.0 111.081 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -59.94 149.74 82.23 Favored 'Trans proline' 0 C--O 1.237 0.428 0 C-N-CA 122.641 2.227 . . . . 0.0 112.032 176.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.88 -36.39 76.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.247 -177.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.7 p -58.56 -42.61 88.34 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.121 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 52.0 m -62.06 -45.86 91.67 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.065 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.493 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 82.3 mttt -57.09 -49.91 74.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.326 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 81.3 t -63.58 -44.88 98.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.012 -177.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -64.83 -38.69 91.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.306 -177.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -64.63 -47.89 76.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.667 0.27 . . . . 0.0 110.469 178.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 86.1 mt -62.23 -41.05 98.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.203 -178.463 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.0 tptt -61.57 -42.27 98.6 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 120.923 0.392 . . . . 0.0 110.266 177.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.9 m -67.45 -17.33 64.66 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.106 179.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.18 -3.59 52.7 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.882 0.372 . . . . 0.0 110.982 177.018 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.24 8.34 47.41 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.922 176.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.5 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.4 mp -75.11 157.15 35.18 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.631 0.729 . . . . 0.0 111.821 -179.118 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.8 m -95.05 160.69 14.45 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.947 172.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.67 -37.69 76.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.897 0.379 . . . . 0.0 111.386 -177.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -70.66 -29.49 65.85 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.438 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -71.37 -44.36 65.16 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.073 0.463 . . . . 0.0 110.233 177.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 60.0 mt -62.49 -42.1 94.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.048 176.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 48.3 t -56.77 -46.29 81.55 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.267 -0.878 . . . . 0.0 110.963 178.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -66.59 -47.53 72.42 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.666 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.24 -42.07 80.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.595 -176.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -61.45 -44.96 96.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.088 0.47 . . . . 0.0 110.78 176.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.1 m -64.71 -33.63 76.42 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.202 0.525 . . . . 0.0 110.297 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.7 mmmt -62.98 -36.56 83.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.38 178.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.508 HG13 ' HB2' ' A' ' 36' ' ' LEU . 19.7 m -89.61 3.69 6.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -174.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.06 18.42 29.29 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.275 -0.964 . . . . 0.0 112.9 177.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -126.77 90.83 48.69 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -71.6 100.34 1.03 Allowed 'Trans proline' 0 N--CA 1.461 -0.4 0 C-N-CA 121.955 1.77 . . . . 0.0 112.816 -175.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -108.33 146.38 33.05 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.989 176.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 39.1 p -89.37 165.84 14.11 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.593 177.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 61.0 tp -63.32 -35.19 79.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.277 0.56 . . . . 0.0 109.599 174.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.95 -40.5 96.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.594 178.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.481 ' O ' HG13 ' A' ' 82' ' ' ILE . 12.5 mm-40 -56.92 -49.27 76.12 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.592 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.5 mm -63.02 -45.44 98.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.742 -176.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -57.63 -42.53 83.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.145 0.497 . . . . 0.0 111.177 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -66.4 -48.02 71.43 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.771 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 78' ' ' GLU . 86.5 mt -62.25 -36.19 73.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.289 -178.102 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.7 mt -78.09 -25.79 47.76 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.078 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 69.9 m . . . . . 0 C--O 1.249 1.054 0 O-C-N 123.84 0.712 . . . . 0.0 112.288 179.47 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 64.1 pttt . . . . . 0 N--CA 1.48 1.038 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -84.28 27.58 0.6 Allowed 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.7 2.267 . . . . 0.0 112.119 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -111.91 67.97 0.66 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.732 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 38.1 t -95.24 -41.23 11.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 175.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -124.33 117.49 24.61 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.414 -1.266 . . . . 0.0 108.843 175.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.409 ' HB2' ' OG ' ' A' ' 23' ' ' SER . 4.8 p-80 -87.11 77.47 9.1 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.547 0.689 . . . . 0.0 111.849 -175.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.4 p -70.98 -29.88 65.99 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.19 176.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 13.9 m170 -66.38 -37.34 85.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.144 178.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.409 ' OG ' ' HB2' ' A' ' 20' ' ' HIS . 16.8 m -67.2 -35.5 79.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.615 178.503 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.477 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 12.9 tp10 -63.69 -41.45 98.13 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.09 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -66.4 -45.0 81.48 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.173 174.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -57.57 -44.36 85.26 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.29 -178.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -71.1 -40.01 71.75 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.843 179.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.477 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 20.6 mtm180 -58.88 -48.97 79.5 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 120.893 0.378 . . . . 0.0 110.6 177.485 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.552 ' O ' HG22 ' A' ' 33' ' ' VAL . 99.2 t -63.12 -45.15 99.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.192 177.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.1 t -58.58 -45.23 89.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.728 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -62.12 -38.72 89.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.072 0.463 . . . . 0.0 110.768 179.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.23 -43.89 63.71 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.066 179.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.552 HG22 ' O ' ' A' ' 29' ' ' VAL . 69.2 t -60.95 -43.18 95.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.553 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -69.65 -35.45 75.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.724 0.297 . . . . 0.0 111.062 179.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -72.6 -43.13 63.74 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 120.991 0.424 . . . . 0.0 110.908 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.524 ' HB2' HG13 ' A' ' 70' ' ' VAL . 91.5 mt -65.71 -30.41 71.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.847 179.319 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.6 mt -85.82 7.15 25.0 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.526 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -78.76 138.87 38.43 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.835 0.35 . . . . 0.0 110.627 -178.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.592 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 14.9 t -57.87 -35.21 70.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.329 -178.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -69.87 -38.84 76.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.148 0.499 . . . . 0.0 110.984 178.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.6 t -79.39 -27.91 13.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.739 -174.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.592 ' HG2' ' O ' ' A' ' 39' ' ' SER . 39.0 ptt180 -64.13 -21.84 66.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.953 0.406 . . . . 0.0 110.735 178.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -88.27 -17.54 30.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.032 -179.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.8 p -86.01 157.04 57.51 Favored Pre-proline 0 C--N 1.326 -0.43 0 C-N-CA 121.055 -0.258 . . . . 0.0 111.089 179.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.412 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 35.7 Cg_endo -64.88 159.81 44.17 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.718 2.278 . . . . 0.0 112.149 177.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.434 HG22 ' HE3' ' A' ' 74' ' ' LYS . 1.3 m -59.8 -41.53 91.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.024 -178.222 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.452 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 10.1 m -58.65 -40.56 83.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.34 -176.142 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.6 m -63.57 -42.38 98.33 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 120.719 0.295 . . . . 0.0 110.999 177.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.412 ' HG3' ' O ' ' A' ' 45' ' ' PRO . 80.8 mttt -59.79 -48.32 82.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.124 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 58.5 t -65.84 -43.22 93.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.887 -177.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 37.1 m170 -62.84 -39.61 94.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.598 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -64.24 -51.08 65.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.554 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.4 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 94.9 mt -60.55 -38.69 85.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.969 -178.02 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.37 -44.18 97.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.165 0.507 . . . . 0.0 110.152 176.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 18.5 m -64.77 -19.34 65.76 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.445 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -85.22 -1.37 56.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.275 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 96.01 12.71 51.82 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.619 177.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.435 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.6 mp -81.57 152.63 27.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.051 0.453 . . . . 0.0 111.033 177.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.511 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 17.8 m -95.6 163.97 12.98 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.422 176.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.18 -37.57 75.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.889 0.376 . . . . 0.0 111.349 -177.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -65.01 -40.76 95.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.485 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.511 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 4.6 mm-40 -64.28 -45.1 89.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.309 0.576 . . . . 0.0 109.514 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 76.6 mt -63.03 -45.48 98.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.9 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 48.2 t -56.81 -45.29 82.35 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.298 -179.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -68.13 -47.36 68.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.806 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.13 -41.78 79.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.486 -179.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -59.32 -47.97 83.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.946 177.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.0 m -63.98 -32.63 74.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.23 0.538 . . . . 0.0 110.322 -179.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mmmt -65.51 -33.99 77.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.065 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.524 HG13 ' HB2' ' A' ' 36' ' ' LEU . 26.0 m -89.14 5.78 4.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.742 0.306 . . . . 0.0 111.701 -177.256 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.78 22.37 33.73 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.532 -0.842 . . . . 0.0 112.326 178.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -127.36 91.03 47.22 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 175.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -70.1 104.45 1.37 Allowed 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 121.788 1.659 . . . . 0.0 112.168 -177.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.434 ' HE3' HG22 ' A' ' 46' ' ' THR . 72.5 mmtt -115.12 137.52 51.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.318 176.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 73.9 p -81.76 162.3 22.97 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 178.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 55.1 tp -62.39 -33.14 74.18 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.417 0.627 . . . . 0.0 109.41 177.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -61.9 -45.2 94.75 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.553 177.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -59.41 -47.0 87.14 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.038 179.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 43.5 mm -59.53 -46.21 93.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.563 -177.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -64.48 -38.43 90.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.027 0.441 . . . . 0.0 111.192 178.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -66.03 -41.41 90.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.822 178.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.452 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 81.1 mt -67.1 -32.22 56.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.23 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 98.7 mt -78.13 -20.82 51.35 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.051 178.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 12.4 m . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.593 -177.567 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.2 pttp . . . . . 0 CA--C 1.531 0.227 0 CA-C-O 120.644 0.259 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.505 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 82.8 mtm-85 -67.8 -44.06 78.23 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 176.545 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.537 ' O ' HG23 ' A' ' 33' ' ' VAL . 87.6 t -61.41 -38.5 80.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.745 175.404 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.2 t -58.32 -45.66 87.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.413 177.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -61.87 -36.6 81.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.22 178.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.39 -45.25 55.88 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.235 -179.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 29' ' ' VAL . 94.7 t -62.4 -40.0 86.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.764 -178.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -68.92 -38.75 79.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.796 0.331 . . . . 0.0 110.753 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -71.74 -42.6 67.06 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.745 -178.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.676 ' HB2' HG11 ' A' ' 70' ' ' VAL . 89.8 mt -67.28 -30.92 70.93 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.155 179.448 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.48 ' HG ' HG12 ' A' ' 70' ' ' VAL . 9.6 mt -85.32 6.04 28.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.565 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.634 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 12.2 t70 -73.94 128.91 36.77 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -53.52 -44.0 68.78 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -175.326 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 86.1 mtm180 -69.11 -33.59 73.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.292 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.535 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 98.5 t -73.59 -28.68 25.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.159 0.504 . . . . 0.0 110.419 178.022 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.634 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 90.9 mtt180 -62.43 -22.26 66.05 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.042 0.449 . . . . 0.0 110.322 173.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 34.9 ttm180 -93.46 -17.07 23.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.332 -177.003 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.6 p -80.31 158.32 71.91 Favored Pre-proline 0 C--N 1.33 -0.277 0 O-C-N 122.269 -0.269 . . . . 0.0 110.654 174.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.411 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 36.9 Cg_endo -67.05 156.3 66.95 Favored 'Trans proline' 0 C--O 1.234 0.324 0 C-N-CA 122.595 2.196 . . . . 0.0 112.234 178.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.508 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -59.66 -37.91 80.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.924 -177.996 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.6 p -58.42 -42.77 87.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.466 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.9 m -63.97 -42.68 97.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.118 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.535 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 78.4 mttt -60.88 -49.45 77.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.284 178.839 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 46' ' ' THR . 63.7 t -65.18 -44.62 95.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.187 -174.67 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 15.7 m170 -63.31 -37.83 88.79 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.217 -177.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -70.57 -45.57 65.15 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.897 -178.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 91.8 mt -61.99 -40.19 94.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.049 -178.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.471 ' HD2' ' C ' ' A' ' 54' ' ' LYS . 0.9 OUTLIER -59.77 -43.7 94.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.323 0.583 . . . . 0.0 109.888 177.521 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.4 m -68.7 -14.36 62.97 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.396 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 35.5 mtpt -87.58 3.67 46.67 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.949 177.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.72 2.4 52.76 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.994 174.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.505 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.8 mp -78.24 154.66 30.83 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.372 0.606 . . . . 0.0 111.663 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.401 ' O ' HG13 ' A' ' 63' ' ' ILE . 16.2 m -95.9 161.22 14.09 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.309 173.862 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.9 -38.66 76.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.855 0.359 . . . . 0.0 111.284 -177.562 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.02 -37.42 87.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.988 178.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -71.53 -39.26 70.85 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.386 -179.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 59' ' ' SER . 80.6 mt -63.16 -43.96 99.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.189 176.246 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 40.7 t -56.71 -42.19 78.73 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.913 177.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -68.18 -48.54 64.99 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.917 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.21 -41.91 80.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.403 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.427 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.8 m-85 -58.81 -46.58 87.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.95 0.405 . . . . 0.0 110.83 176.353 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 20.8 m -65.21 -33.05 75.08 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.108 0.48 . . . . 0.0 110.081 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -63.28 -35.77 81.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.642 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.676 HG11 ' HB2' ' A' ' 36' ' ' LEU . 23.0 m -88.46 5.23 4.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-O 120.992 0.425 . . . . 0.0 111.643 -177.279 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 93.53 18.89 36.8 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.662 177.334 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -121.58 91.01 48.37 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.55 99.46 1.22 Allowed 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 121.982 1.788 . . . . 0.0 112.368 -177.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -109.85 144.29 38.51 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.645 176.614 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.435 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 24.3 p -81.79 157.81 24.35 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 175.354 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 53.6 tp -60.78 -32.66 71.97 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.107 0.479 . . . . 0.0 110.568 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -59.78 -42.19 92.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.745 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.435 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 58.1 mm-40 -59.47 -48.66 80.79 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.291 178.018 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 46.1 mm -60.36 -48.41 88.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.037 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -63.48 -38.14 90.0 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.861 0.362 . . . . 0.0 110.648 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.6 ttm180 -61.95 -48.71 79.17 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.924 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 78' ' ' GLU . 69.2 mt -64.34 -33.09 60.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.072 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.409 HD21 HG12 ' A' ' 50' ' ' VAL . 79.2 mt -79.2 -17.25 55.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.766 -179.424 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.6 p . . . . . 0 C--O 1.252 1.206 0 CA-C-O 118.308 -0.853 . . . . 0.0 110.621 179.598 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.8 pttt . . . . . 0 C--O 1.227 -0.099 0 CA-C-O 120.692 0.282 . . . . 0.0 110.598 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.465 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 83.3 mtm180 -69.93 -40.4 75.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.66 -179.41 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.494 ' O ' HG23 ' A' ' 33' ' ' VAL . 84.6 t -62.49 -42.24 95.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 175.106 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.6 t -61.95 -42.36 99.03 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.49 178.401 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -61.37 -36.88 81.46 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 121.268 0.556 . . . . 0.0 110.472 177.663 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.433 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -73.34 -44.74 58.26 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.05 179.443 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 29' ' ' VAL . 78.2 t -60.81 -43.21 94.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.403 -179.267 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -68.23 -34.61 76.55 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.686 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -72.78 -43.59 62.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.657 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.762 ' HB2' HG11 ' A' ' 70' ' ' VAL . 94.8 mt -68.47 -32.16 71.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.111 0.481 . . . . 0.0 111.327 -178.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.9 mt -86.4 7.05 27.28 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.433 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.605 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 9.5 t70 -81.59 134.8 35.54 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.4 p -56.64 -32.9 65.79 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.696 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -68.13 -43.07 79.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.133 0.492 . . . . 0.0 110.571 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.418 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.5 t -78.04 -24.14 13.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.072 -175.494 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.605 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 83.9 mtt180 -60.97 -21.8 63.86 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.906 0.384 . . . . 0.0 110.358 173.684 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -85.69 -18.79 32.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.261 -177.045 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 p -88.32 155.81 51.48 Favored Pre-proline 0 C--N 1.328 -0.369 0 O-C-N 122.439 -0.163 . . . . 0.0 111.155 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.42 156.32 65.86 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.757 2.304 . . . . 0.0 112.04 176.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.443 HG21 ' HE3' ' A' ' 74' ' ' LYS . 2.2 m -60.06 -40.17 88.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.476 -176.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.6 m -58.55 -38.39 77.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.015 -177.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.1 m -65.55 -45.17 84.41 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.629 177.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.567 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 82.1 mttt -57.34 -48.59 78.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.058 178.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.509 HG12 HD21 ' A' ' 83' ' ' LEU . 57.9 t -63.84 -46.02 95.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.191 -177.456 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 17.0 m170 -64.53 -39.5 93.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.81 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -66.2 -42.72 88.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.097 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 67.3 mt -63.69 -34.76 78.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.804 178.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.532 ' HD3' HD22 ' A' ' 83' ' ' LEU . 33.8 ttpt -61.09 -44.36 97.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.805 0.336 . . . . 0.0 110.222 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.4 p -72.41 -12.98 61.34 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.515 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -81.98 1.35 35.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.859 0.361 . . . . 0.0 110.936 176.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 93.98 14.43 52.03 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.364 178.207 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.465 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 5.9 mp -91.49 147.99 22.62 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.013 0.435 . . . . 0.0 111.589 179.269 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.423 ' O ' HG13 ' A' ' 63' ' ' ILE . 1.9 m -92.72 173.25 7.86 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.006 173.356 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.87 -36.01 76.0 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.712 0.292 . . . . 0.0 111.087 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.7 mp0 -66.43 -45.23 80.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.919 -179.258 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -62.88 -43.32 99.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.523 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.426 HG23 HD12 ' A' ' 53' ' ' LEU . 78.2 mt -63.08 -45.12 99.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.649 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.5 t -57.78 -45.2 86.33 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.213 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.692 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 33.4 tt0 -67.35 -47.64 69.85 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.602 -178.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.545 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.89 -45.38 82.59 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.137 -178.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.574 ' O ' HG22 ' A' ' 70' ' ' VAL . 2.7 m-85 -57.98 -42.23 84.64 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.193 178.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.1 m -67.16 -33.29 75.1 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.177 0.513 . . . . 0.0 110.416 -177.215 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.692 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 20.1 mtpp -72.39 -29.79 64.07 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.986 -179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.762 HG11 ' HB2' ' A' ' 36' ' ' LEU . 10.8 m -83.75 0.27 4.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.854 0.359 . . . . 0.0 111.534 -178.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 96.13 18.33 31.84 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.42 178.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -127.46 91.15 46.7 Favored Pre-proline 0 C--N 1.323 -0.587 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -73.72 93.78 0.86 Allowed 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 121.992 1.795 . . . . 0.0 112.817 -175.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.443 ' HE3' HG21 ' A' ' 46' ' ' THR . 74.2 mmtt -103.65 137.46 41.67 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.482 175.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.452 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 70.0 p -77.47 162.92 26.8 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.263 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 44.3 tp -62.53 -32.63 73.6 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.119 -0.696 . . . . 0.0 109.119 175.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -60.35 -46.32 90.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.818 176.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.452 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 36.7 mm-40 -59.57 -45.88 90.55 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.09 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.419 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 39.4 mm -60.21 -46.78 94.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.524 -177.559 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -64.39 -39.52 94.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.932 0.396 . . . . 0.0 110.659 177.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.9 tpp180 -60.18 -46.55 89.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.393 177.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.5 mt -67.93 -31.99 54.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.202 -178.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.532 HD22 ' HD3' ' A' ' 54' ' ' LYS . 91.8 mt -82.64 -4.03 57.13 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.741 0.305 . . . . 0.0 111.358 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 45.5 m . . . . . 0 C--O 1.252 1.208 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.614 177.513 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.4 pttt . . . . . 0 CA--C 1.531 0.229 0 CA-C-O 120.535 0.207 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.1 mtm-85 -70.47 -41.13 73.14 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 122.29 -0.256 . . . . 0.0 111.572 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.474 ' O ' HG23 ' A' ' 33' ' ' VAL . 75.2 t -66.01 -39.37 84.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 121.066 -0.253 . . . . 0.0 110.537 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.9 m -58.6 -40.59 83.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.71 0.29 . . . . 0.0 110.49 176.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.449 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 29.8 m-80 -66.55 -36.29 82.31 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.957 177.185 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.48 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -72.38 -45.22 60.76 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.441 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.58 HG13 HG12 ' A' ' 70' ' ' VAL . 78.2 t -61.36 -41.46 89.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.623 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 11.2 pt-20 -68.4 -33.64 74.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 0.0 110.658 178.601 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -71.88 -43.57 65.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.627 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.836 ' HB2' HG11 ' A' ' 70' ' ' VAL . 96.5 mt -67.75 -30.3 69.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.248 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.8 mt -85.82 4.24 38.01 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.018 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.549 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 18.4 t70 -75.04 132.81 41.58 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 177.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.5 m -53.66 -39.98 65.5 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 -174.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -69.17 -47.47 64.85 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.036 0.445 . . . . 0.0 110.327 178.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.3 t -66.65 -25.64 35.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.975 -177.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.549 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 83.0 mtp180 -65.52 -22.13 66.69 Favored 'General case' 0 C--N 1.319 -0.737 0 O-C-N 122.151 -0.343 . . . . 0.0 111.371 175.601 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 74.9 mtm180 -101.67 6.99 42.17 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -175.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.601 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -96.14 169.92 8.32 Favored Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 175.116 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.601 ' HD2' HG22 ' A' ' 44' ' ' THR . 57.2 Cg_endo -71.05 157.53 57.56 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.335 2.023 . . . . 0.0 111.906 175.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.478 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.3 OUTLIER -68.5 -39.83 81.12 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.524 -176.82 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.8 m -58.86 -35.8 73.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.521 -175.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.462 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 70.1 m -64.06 -44.82 91.29 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.221 0.534 . . . . 0.0 110.915 179.357 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.481 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 24.5 mttm -63.56 -45.47 90.37 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.502 -178.047 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 77.8 t -62.51 -44.62 99.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.57 -177.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 31.1 m170 -64.84 -38.24 90.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.401 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.491 ' O ' ' HG3' ' A' ' 56' ' ' LYS . 55.8 t80 -68.82 -43.37 75.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.725 -179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 76.8 mt -66.26 -38.7 88.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.756 0.312 . . . . 0.0 110.793 179.376 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -60.37 -40.6 91.42 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.242 0.544 . . . . 0.0 109.763 173.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.0 t -68.64 -20.03 64.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.244 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 52' ' ' PHE . 28.9 mtpp -81.5 -7.83 59.64 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.904 177.047 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.95 10.55 39.65 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.832 178.334 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.8 mp -82.31 145.13 30.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.276 0.56 . . . . 0.0 111.77 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.443 ' O ' HG13 ' A' ' 63' ' ' ILE . 8.6 m -85.42 164.82 17.66 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.123 175.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.33 -35.44 71.9 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.137 0.494 . . . . 0.0 110.404 178.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -62.79 -48.94 76.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.703 177.506 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -64.9 -44.49 89.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.242 -177.045 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 59' ' ' SER . 73.2 mt -59.77 -41.79 86.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.258 178.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.1 t -59.31 -44.52 92.55 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.609 178.429 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -68.3 -45.92 71.72 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.192 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.565 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.56 -45.32 81.31 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.515 -178.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.573 ' O ' HG22 ' A' ' 70' ' ' VAL . 7.6 m-85 -59.95 -45.05 93.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.107 0.479 . . . . 0.0 110.934 178.476 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.0 m -64.82 -33.13 75.26 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.622 -178.107 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.556 ' HE3' HG21 ' A' ' 33' ' ' VAL . 20.1 mtmt -71.77 -32.14 67.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.652 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.836 HG11 ' HB2' ' A' ' 36' ' ' LEU . 13.4 m -81.64 -3.83 7.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.714 0.292 . . . . 0.0 111.286 -177.554 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 100.01 18.21 22.97 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.298 179.234 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -126.6 90.94 48.59 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -73.63 97.18 0.95 Allowed 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 121.993 1.795 . . . . 0.0 112.748 -174.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.478 ' HE3' HG21 ' A' ' 46' ' ' THR . 74.3 mmtt -107.38 137.76 44.83 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.914 174.178 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.502 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 45.4 p -82.22 169.21 16.84 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.477 178.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.2 tp -62.9 -33.54 75.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.368 0.604 . . . . 0.0 109.811 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -60.27 -45.44 93.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.798 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.502 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 12.2 mm-40 -60.78 -47.15 87.63 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.052 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 42.6 mm -60.17 -46.15 94.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.805 -177.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 60.3 mttm -64.02 -40.06 95.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.363 . . . . 0.0 111.069 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -64.55 -43.61 93.4 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.74 178.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 72.7 mt -66.92 -31.73 54.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.618 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.9 mt -81.09 -6.85 59.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.482 177.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 14.4 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.433 -0.794 . . . . 0.0 109.746 177.175 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 120.585 0.231 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.572 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 82.7 mtm-85 -68.36 -44.23 75.68 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.862 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.57 ' O ' HG23 ' A' ' 33' ' ' VAL . 94.2 t -60.9 -41.94 90.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 110.027 -0.361 . . . . 0.0 110.027 177.173 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.0 t -60.64 -45.55 93.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.842 0.353 . . . . 0.0 110.404 178.087 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -62.86 -35.31 79.57 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.996 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.39 -44.73 64.4 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.152 179.399 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.578 HG13 HG12 ' A' ' 70' ' ' VAL . 87.4 t -60.98 -42.69 93.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.56 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -68.65 -35.18 76.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.839 179.577 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -71.76 -43.25 66.09 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-O 120.925 0.393 . . . . 0.0 110.791 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.762 ' HB2' HG11 ' A' ' 70' ' ' VAL . 87.1 mt -65.24 -30.68 71.58 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.329 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.449 ' HA ' HD23 ' A' ' 37' ' ' LEU . 13.0 mt -85.72 7.47 23.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.979 -178.339 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.48 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 13.5 t70 -78.99 138.06 37.87 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 176.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.0 m -57.09 -39.63 75.39 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -176.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -68.22 -37.09 80.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.059 0.457 . . . . 0.0 110.412 -179.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.552 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 70.7 t -75.13 -34.01 30.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.758 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.48 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 84.0 mtp180 -63.84 -21.14 66.3 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.03 0.443 . . . . 0.0 110.303 174.346 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -88.52 -17.49 30.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.026 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.5 p -85.52 159.7 55.18 Favored Pre-proline 0 C--N 1.329 -0.309 0 O-C-N 122.195 -0.316 . . . . 0.0 110.848 177.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.25 158.9 49.81 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.625 2.217 . . . . 0.0 112.021 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.472 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.3 OUTLIER -61.77 -39.6 92.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.541 -176.052 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.43 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 7.6 t -59.38 -43.1 92.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.765 -176.815 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.3 m -60.33 -42.89 96.57 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.021 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.552 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 79.9 mttt -60.26 -49.1 78.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.001 178.036 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.476 HG12 HD21 ' A' ' 83' ' ' LEU . 59.2 t -65.59 -44.26 93.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.809 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 22.5 m170 -63.9 -37.41 87.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.013 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -66.89 -44.36 81.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.463 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 89.0 mt -66.5 -41.15 89.31 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.887 -178.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.459 ' HD2' ' O ' ' A' ' 58' ' ' LEU . 42.4 tptt -62.84 -37.33 86.4 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.181 0.515 . . . . 0.0 109.926 176.331 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 35.5 t -70.98 -14.24 62.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.821 178.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 37.4 mtpt -91.46 2.1 56.66 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.998 0.428 . . . . 0.0 110.933 176.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.91 6.12 57.18 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.59 -0.814 . . . . 0.0 113.026 176.396 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.572 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.4 mp -73.19 153.0 40.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.201 0.524 . . . . 0.0 111.283 178.534 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.2 m -92.89 161.86 14.31 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.336 172.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.13 -42.61 86.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.798 0.332 . . . . 0.0 111.147 -177.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -62.16 -38.32 88.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.03 178.577 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.85 -41.98 86.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.048 0.451 . . . . 0.0 110.384 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.434 HG21 HG13 ' A' ' 50' ' ' VAL . 71.8 mt -63.6 -45.2 98.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.402 176.21 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 45.2 t -56.8 -42.6 79.79 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.016 178.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 57.3 tt0 -66.35 -48.42 70.28 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.659 178.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.521 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.72 -47.91 78.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.093 -178.228 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.617 ' O ' HG22 ' A' ' 70' ' ' VAL . 5.2 m-85 -55.29 -46.83 76.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.022 0.439 . . . . 0.0 111.308 178.254 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.4 m -65.48 -32.63 74.34 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.961 0.41 . . . . 0.0 110.697 -177.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.5 ' HE3' HG21 ' A' ' 33' ' ' VAL . 21.8 mtmt -72.12 -28.88 63.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.769 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.762 HG11 ' HB2' ' A' ' 36' ' ' LEU . 10.6 m -84.18 -1.21 6.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.08 0.467 . . . . 0.0 111.193 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.09 14.05 43.72 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.449 178.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -121.22 90.6 47.57 Favored Pre-proline 0 C--N 1.322 -0.615 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -70.87 105.2 1.62 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.012 1.808 . . . . 0.0 112.167 -175.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -116.35 138.39 51.37 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.791 176.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.1 p -82.03 159.28 23.51 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.34 179.332 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 55.4 tp -61.7 -32.85 73.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.287 0.565 . . . . 0.0 109.661 177.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -57.01 -46.38 82.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.018 177.035 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.428 ' O ' HG13 ' A' ' 82' ' ' ILE . 38.3 mt-10 -63.33 -46.94 84.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.527 179.226 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 46.9 mm -59.93 -44.39 94.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.919 -176.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -63.77 -43.09 97.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.058 0.456 . . . . 0.0 110.773 178.059 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -63.33 -44.72 94.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.979 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.43 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 96.4 mt -63.84 -36.64 77.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.101 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.476 HD21 HG12 ' A' ' 50' ' ' VAL . 75.5 mt -77.53 -25.39 50.19 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.289 -179.438 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 7.1 t . . . . . 0 C--O 1.254 1.3 0 CA-C-O 118.181 -0.914 . . . . 0.0 109.996 -179.107 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.445 0.164 . . . . 0.0 111.015 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.516 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 88.4 mtm-85 -69.46 -39.55 77.67 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.908 0.385 . . . . 0.0 110.204 177.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.643 ' O ' HG23 ' A' ' 33' ' ' VAL . 71.2 t -62.75 -43.57 98.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.109 174.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 45.3 m -58.0 -45.86 86.16 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.749 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -61.66 -37.64 84.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.092 0.472 . . . . 0.0 110.928 178.277 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.49 -44.38 62.34 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.46 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.643 HG23 ' O ' ' A' ' 29' ' ' VAL . 67.7 t -61.07 -43.3 95.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.023 0.44 . . . . 0.0 110.355 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -69.22 -35.96 76.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.794 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -72.32 -43.48 64.09 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.834 0.35 . . . . 0.0 110.994 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.619 ' HB2' HG11 ' A' ' 70' ' ' VAL . 75.0 mt -63.61 -31.1 72.16 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.491 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 37' ' ' LEU . 11.7 mt -85.89 6.99 25.83 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -178.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -77.07 139.38 39.99 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.717 -0.393 . . . . 0.0 109.989 177.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.564 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 14.5 m -57.89 -37.04 73.26 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.933 -175.62 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 33.4 mmt180 -69.57 -38.5 77.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.155 0.502 . . . . 0.0 110.587 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.582 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 58.2 t -74.5 -34.52 35.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.132 -176.511 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' ' 39' ' ' SER . 22.4 ptt180 -67.63 -21.37 65.39 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.877 0.37 . . . . 0.0 110.254 176.48 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -89.28 -7.11 56.1 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.686 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.4 p -96.96 158.4 33.46 Favored Pre-proline 0 C--N 1.326 -0.451 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.012 176.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -62.46 154.88 61.31 Favored 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.703 2.268 . . . . 0.0 111.95 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.446 ' O ' HG23 ' A' ' 50' ' ' VAL . 1.3 m -60.27 -35.63 75.96 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.859 -178.538 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.3 m -58.24 -42.87 87.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.786 -178.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.2 m -63.25 -45.74 90.15 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.873 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.582 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 82.2 mttt -57.46 -49.99 74.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.179 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 46' ' ' THR . 80.9 t -64.23 -43.54 97.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.925 -176.515 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 26.2 m170 -64.56 -37.48 87.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.081 -178.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -69.68 -42.68 73.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.387 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 68.7 mt -64.46 -39.26 93.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.674 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.44 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 29.8 tptt -63.87 -39.93 95.36 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 120.967 0.413 . . . . 0.0 110.102 176.419 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.2 t -69.63 -14.35 62.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.713 178.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -83.86 -1.61 54.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.793 176.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.42 17.92 47.72 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.627 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.516 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.4 mp -83.03 159.0 22.27 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.265 0.555 . . . . 0.0 111.043 177.817 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.1 m -100.59 165.23 11.51 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.438 -0.801 . . . . 0.0 108.897 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.95 -34.51 69.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.906 0.384 . . . . 0.0 110.821 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.97 -49.62 76.95 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.905 177.426 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -63.67 -43.64 96.12 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.902 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 78.5 mt -60.84 -44.96 98.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.715 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.6 t -60.81 -43.39 98.25 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.7 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.417 ' OE1' HG21 ' A' ' 29' ' ' VAL . 27.5 tt0 -68.85 -48.54 63.22 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.123 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.79 -41.57 82.39 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 120.726 0.298 . . . . 0.0 111.551 -178.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.403 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.1 m-85 -60.93 -45.43 94.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.578 176.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 20.8 m -64.85 -34.33 78.11 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.043 0.449 . . . . 0.0 110.292 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.0 mmmt -63.14 -32.5 73.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.962 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.619 HG11 ' HB2' ' A' ' 36' ' ' LEU . 24.1 m -91.95 8.1 4.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.97 0.414 . . . . 0.0 111.401 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.41 23.7 33.34 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.794 177.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -126.61 91.31 47.71 Favored Pre-proline 0 C--N 1.32 -0.682 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 176.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -72.09 102.92 1.41 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 121.899 1.732 . . . . 0.0 111.744 -178.492 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -108.93 139.35 43.91 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.657 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 38.1 p -80.49 156.64 26.45 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.183 178.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 38.9 tp -63.25 -32.69 74.16 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.126 0.488 . . . . 0.0 109.943 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -60.36 -45.17 94.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.723 177.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -59.04 -47.58 84.72 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.511 177.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.0 mm -59.8 -45.19 95.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.433 -178.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.2 -44.99 93.79 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.868 0.366 . . . . 0.0 110.874 177.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.3 tpp180 -61.65 -47.22 86.38 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.943 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 86.3 mt -64.6 -34.45 69.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.765 -179.663 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 80.8 mt -81.61 -4.3 55.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.794 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 38.4 m . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.836 -0.602 . . . . 0.0 110.282 176.004 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt . . . . . 0 N--CA 1.456 -0.151 0 CA-C-O 120.514 0.197 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 51.6 mtm-85 -69.74 -40.23 76.3 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.52 0.2 . . . . 0.0 111.138 -177.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.652 ' O ' HG23 ' A' ' 33' ' ' VAL . 81.6 t -60.57 -43.7 95.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 175.103 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.3 m -62.16 -38.23 88.25 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.198 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.44 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 95.1 m-20 -61.79 -37.13 83.21 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.25 0.547 . . . . 0.0 110.382 177.362 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.05 -44.92 52.54 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.211 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.652 HG23 ' O ' ' A' ' 29' ' ' VAL . 61.8 t -61.58 -39.94 84.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.832 0.349 . . . . 0.0 110.544 -178.699 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 12.7 pt-20 -68.72 -38.46 80.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.91 178.162 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -72.38 -43.28 64.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.821 0.343 . . . . 0.0 110.935 -179.375 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.665 ' HB2' HG11 ' A' ' 70' ' ' VAL . 88.7 mt -66.15 -31.15 71.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.595 -177.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.518 ' HG ' HG12 ' A' ' 70' ' ' VAL . 11.3 mt -86.03 4.62 37.12 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -177.743 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.552 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 12.4 t70 -75.46 138.18 41.45 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.233 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.2 t -53.95 -37.71 64.17 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.389 -178.14 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 73.2 mtm180 -68.54 -46.52 69.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.393 0.616 . . . . 0.0 110.414 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.444 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.2 t -71.41 -29.46 35.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.209 -174.04 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.552 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 78.6 mtp180 -65.38 -21.96 66.74 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.213 177.344 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 25.2 mtm180 -90.12 -17.09 28.3 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.646 0.239 . . . . 0.0 111.646 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.3 p -83.64 159.17 61.59 Favored Pre-proline 0 C--N 1.326 -0.42 0 C-N-CA 121.238 -0.185 . . . . 0.0 110.89 177.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.45 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 35.8 Cg_endo -65.09 159.45 46.63 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.659 2.24 . . . . 0.0 112.512 177.632 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.415 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.7 OUTLIER -61.76 -39.73 92.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.22 -177.749 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 5.9 m -58.26 -40.96 83.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.278 -177.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 63.7 m -62.97 -46.64 86.76 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.736 177.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.542 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 80.7 mttt -56.99 -49.01 77.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.313 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 46' ' ' THR . 91.2 t -64.2 -45.02 97.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.268 -176.091 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 17.8 m170 -64.84 -38.93 92.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.017 -178.317 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -64.14 -42.93 96.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.277 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 87.7 mt -65.71 -37.97 87.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.848 -179.452 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -60.84 -42.24 97.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.005 174.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.4 t -69.59 -13.67 62.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.631 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.8 mmpt? -85.6 -3.04 58.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.626 175.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.1 17.37 40.68 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.637 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.2 mp -88.38 152.53 21.85 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.397 0.618 . . . . 0.0 111.934 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.2 m -93.52 164.91 13.0 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.743 175.443 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.23 -37.46 74.9 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.897 0.379 . . . . 0.0 110.839 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.443 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 1.6 mp0 -62.44 -46.87 86.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.42 178.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -65.63 -40.5 92.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.621 -177.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.4 HG23 HD12 ' A' ' 53' ' ' LEU . 87.8 mt -64.64 -45.8 94.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.608 177.124 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 31.3 t -56.68 -44.76 81.78 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.165 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -68.27 -45.86 71.97 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.066 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 69' ' ' LYS . . . -57.76 -40.76 80.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.737 0.303 . . . . 0.0 111.473 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.416 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.2 m-85 -60.04 -45.41 92.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.654 176.099 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.3 m -65.32 -33.08 75.13 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.229 0.538 . . . . 0.0 109.803 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 66' ' ' ALA . 27.0 mmmt -62.06 -35.77 79.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.937 177.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.665 HG11 ' HB2' ' A' ' 36' ' ' LEU . 22.1 m -89.89 5.37 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.822 0.344 . . . . 0.0 111.577 -176.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 94.66 13.5 53.31 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.875 176.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -119.42 90.81 43.21 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -72.43 102.31 1.37 Allowed 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 121.849 1.699 . . . . 0.0 112.053 -178.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -111.21 138.42 47.67 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.837 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 32.9 p -76.74 158.9 30.61 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.516 178.057 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 49.5 tp -62.99 -32.96 74.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.146 0.498 . . . . 0.0 109.947 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -58.72 -45.29 89.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.758 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.2 mm-40 -59.14 -48.76 80.43 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.521 178.346 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.7 mm -60.51 -44.19 95.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.678 -177.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -63.14 -44.04 96.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.932 177.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -60.99 -43.0 99.47 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.109 178.631 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 77.0 mt -66.68 -36.58 77.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.942 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 83.6 mt -77.74 -24.66 48.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.403 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 51.8 p . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.613 -0.708 . . . . 0.0 110.317 179.378 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.1 pttt . . . . . 0 N--CA 1.457 -0.091 0 CA-C-O 120.319 0.104 . . . . 0.0 110.9 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.472 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 29.0 mtm180 -62.52 -47.36 84.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.799 0.333 . . . . 0.0 110.379 178.124 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.516 ' O ' HG23 ' A' ' 33' ' ' VAL . 75.6 t -65.0 -39.89 87.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.075 177.308 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.0 m -58.04 -46.57 85.13 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.775 177.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -63.02 -36.47 83.68 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.172 178.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.405 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -71.68 -44.92 63.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.05 -179.693 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.516 HG23 ' O ' ' A' ' 29' ' ' VAL . 82.2 t -61.18 -43.13 95.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.55 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -68.36 -35.53 77.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.9 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -72.43 -43.76 63.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.813 0.34 . . . . 0.0 110.677 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.68 ' HB2' HG11 ' A' ' 70' ' ' VAL . 86.6 mt -64.8 -29.95 70.94 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.563 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 37' ' ' LEU . 19.6 mt -85.04 7.69 20.54 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.088 -176.103 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.658 ' OD2' ' HG2' ' A' ' 40' ' ' ARG . 9.4 t70 -85.37 139.06 31.86 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.104 177.317 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.649 ' O ' ' HG3' ' A' ' 43' ' ' ARG . 27.1 t -55.52 -41.15 72.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.238 -178.068 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.658 ' HG2' ' OD2' ' A' ' 38' ' ' ASP . 11.0 ptm180 -67.81 -32.56 73.21 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.035 0.445 . . . . 0.0 110.646 -177.165 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.567 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 98.8 t -78.98 -33.18 15.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.444 -178.34 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 82.7 mtp180 -66.56 -22.04 66.15 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.909 175.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.649 ' HG3' ' O ' ' A' ' 39' ' ' SER . 67.9 mtt180 -86.15 -18.32 32.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.464 -178.659 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.08 158.73 58.15 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 121.187 -0.205 . . . . 0.0 110.822 177.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.37 154.02 73.66 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.381 2.054 . . . . 0.0 112.015 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -34.43 73.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.952 -177.722 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.6 p -58.54 -43.1 89.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.843 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 62.0 m -64.78 -44.67 89.24 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.124 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.567 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 82.9 mttt -56.98 -49.38 75.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.078 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 62.3 t -67.73 -43.62 86.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.009 -176.532 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 25.2 m170 -65.04 -36.68 85.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.595 -177.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.45 ' O ' ' HG3' ' A' ' 56' ' ' LYS . 72.6 t80 -69.94 -45.45 67.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.45 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 98.9 mt -62.87 -40.84 98.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.075 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.423 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 46.5 tptt -62.96 -40.0 96.36 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.427 177.582 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.3 t -70.79 -13.78 62.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.637 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' A' ' 52' ' ' PHE . 39.4 mtpt -86.12 -2.8 58.67 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.189 177.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 102.04 9.22 42.98 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.886 177.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.472 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.9 mp -80.6 156.01 26.62 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.44 0.638 . . . . 0.0 111.62 178.515 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.422 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 20.1 m -98.71 168.89 9.86 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.538 174.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.18 95.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.686 0.279 . . . . 0.0 111.113 -177.247 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -60.53 -40.85 93.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.938 177.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.422 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 6.3 mm-40 -63.1 -47.97 80.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.961 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 61.9 mt -64.65 -45.41 95.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.72 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.6 t -56.98 -45.02 83.25 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.946 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -67.76 -47.02 70.42 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.909 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.552 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -57.19 -47.26 81.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.052 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.578 ' O ' HG22 ' A' ' 70' ' ' VAL . 2.7 m-85 -56.44 -44.23 80.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.105 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.1 m -66.15 -33.54 76.01 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.807 0.337 . . . . 0.0 110.65 -177.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.492 ' HE3' HG21 ' A' ' 33' ' ' VAL . 22.4 mtmt -70.91 -30.95 67.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.795 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.68 HG11 ' HB2' ' A' ' 36' ' ' LEU . 7.9 m -83.47 -0.83 5.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.848 0.356 . . . . 0.0 111.287 -177.518 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 96.28 19.87 26.91 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.483 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -127.81 91.3 45.57 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 177.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.84 101.14 1.15 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 121.892 1.728 . . . . 0.0 112.57 -175.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -109.46 139.35 44.55 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.044 176.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 34.7 p -82.45 164.55 20.89 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.113 176.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.1 tp -63.08 -32.73 74.18 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 176.107 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -59.52 -45.62 91.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.475 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -58.69 -46.94 86.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.216 178.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 41.6 mm -61.59 -45.36 98.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.786 -177.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -64.14 -39.53 94.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.998 0.428 . . . . 0.0 110.479 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -59.89 -48.63 80.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.898 177.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.3 mt -69.85 -33.37 55.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.828 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 75.5 mt -82.97 1.64 38.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.745 0.307 . . . . 0.0 111.598 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 26.2 t . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.577 -0.725 . . . . 0.0 109.264 176.026 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.6 pttt . . . . . 0 N--CA 1.455 -0.214 0 N-CA-C 110.387 -0.227 . . . . 0.0 110.387 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.493 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 21.2 mtm180 -65.46 -45.52 83.42 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.645 ' O ' HG23 ' A' ' 33' ' ' VAL . 73.3 t -60.63 -46.39 95.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.843 175.311 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.1 t -59.68 -42.83 93.82 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.171 -179.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -61.83 -36.85 82.39 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.051 0.453 . . . . 0.0 110.632 177.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.447 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -72.28 -41.86 66.21 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.878 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 29' ' ' VAL . 93.6 t -61.0 -46.55 96.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 120.869 0.366 . . . . 0.0 110.246 179.066 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -68.75 -33.65 74.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.815 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -71.42 -43.59 66.48 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.056 0.455 . . . . 0.0 110.615 179.03 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.635 ' HB2' HG11 ' A' ' 70' ' ' VAL . 93.2 mt -66.81 -32.24 73.4 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.884 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.2 mt -88.69 6.31 39.09 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -77.24 138.18 39.26 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.519 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 48.7 m -59.81 -33.93 72.39 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 -176.088 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.529 ' HG2' HG23 ' A' ' 41' ' ' VAL . 7.5 ptp180 -70.63 -40.58 73.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.069 0.461 . . . . 0.0 110.142 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.529 HG23 ' HG2' ' A' ' 40' ' ' ARG . 47.6 t -80.32 -26.96 11.7 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.856 -173.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.519 ' HG2' ' O ' ' A' ' 39' ' ' SER . 37.5 ptt180 -64.37 -20.29 66.03 Favored 'General case' 0 C--N 1.318 -0.799 0 O-C-N 121.738 -0.601 . . . . 0.0 111.222 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -83.43 -17.77 40.99 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -176.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.519 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -85.98 169.84 14.46 Favored Pre-proline 0 CA--C 1.536 0.442 0 O-C-N 122.44 -0.163 . . . . 0.0 111.348 -176.118 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.519 ' HD2' HG22 ' A' ' 44' ' ' THR . 44.2 Cg_endo -69.14 162.88 39.94 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.467 2.111 . . . . 0.0 112.191 174.455 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.46 -45.01 73.59 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.834 -176.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.1 m -58.44 -38.01 76.6 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.95 -174.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.8 m -60.27 -42.86 96.3 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 121.114 0.483 . . . . 0.0 110.873 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.493 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 25.3 mttm -63.71 -45.0 91.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.516 -178.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 60.3 t -63.17 -43.25 98.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.653 -178.55 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -64.59 -37.62 88.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.658 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -67.27 -46.27 74.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.531 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 96.2 mt -61.86 -39.62 92.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.746 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 51.1 tptt -59.87 -42.81 94.53 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.518 175.078 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.0 t -70.97 -19.32 62.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.841 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 55.3 mmtt -82.04 -3.56 54.86 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.989 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 102.14 9.0 43.29 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.566 -0.826 . . . . 0.0 112.824 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.493 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.4 mp -82.55 149.36 27.54 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.381 0.61 . . . . 0.0 111.315 179.124 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.417 ' H ' ' HG3' ' A' ' 62' ' ' GLU . 39.6 m -94.18 169.58 10.14 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.559 174.239 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.1 -37.78 77.96 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.861 0.363 . . . . 0.0 110.875 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.21 -44.85 92.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.401 177.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.421 ' H ' ' HG2' ' A' ' 62' ' ' GLU . 4.5 mm-40 -63.17 -48.29 79.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.877 -178.572 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 61.3 mt -63.38 -43.54 98.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.946 -178.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 52.6 t -57.51 -44.1 84.75 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.848 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -68.57 -48.46 64.17 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.905 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.18 -41.11 78.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.883 -178.027 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.424 ' O ' HG22 ' A' ' 70' ' ' VAL . 6.6 m-85 -61.26 -45.9 92.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.849 0.357 . . . . 0.0 110.635 177.257 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.5 m -63.08 -35.35 79.95 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.105 0.479 . . . . 0.0 110.125 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.409 ' HB2' HG22 ' A' ' 33' ' ' VAL . 29.0 mmtt -60.93 -36.46 79.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.45 178.344 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.635 HG11 ' HB2' ' A' ' 36' ' ' LEU . 18.6 m -90.6 9.59 3.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.543 -175.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.62 16.07 57.32 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.799 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.404 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 6.5 tp-100 -121.75 90.64 48.39 Favored Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 177.344 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.07 95.86 0.85 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 121.955 1.77 . . . . 0.0 112.588 -176.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -103.63 137.72 41.29 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.678 175.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 41.7 p -77.68 161.72 27.56 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.136 177.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.454 ' HG ' ' HE3' ' A' ' 80' ' ' LYS . 62.6 tp -61.65 -32.94 73.13 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.284 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -60.34 -44.25 95.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.997 176.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -57.45 -49.13 77.25 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.088 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 41.1 mm -60.77 -41.83 89.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.449 -177.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.454 ' HE3' ' HG ' ' A' ' 76' ' ' LEU . 96.1 mttt -61.18 -44.08 97.87 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.151 177.617 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.0 tpp180 -62.58 -46.14 89.7 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.598 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 83.9 mt -65.3 -36.56 78.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.131 -178.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 72.2 mt -80.91 -4.57 55.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.617 0.246 . . . . 0.0 111.638 178.451 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 19.9 t . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.732 -0.652 . . . . 0.0 109.629 178.033 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt . . . . . 0 N--CA 1.456 -0.15 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.408 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 21.2 mtm180 -70.04 -41.55 74.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.344 178.285 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.464 ' O ' HG23 ' A' ' 33' ' ' VAL . 69.3 t -61.1 -44.52 98.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.09 174.353 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.3 m -60.84 -43.29 98.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.837 178.536 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -61.75 -35.84 79.28 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.068 0.461 . . . . 0.0 110.681 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.48 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -72.07 -44.8 62.74 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.953 178.347 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.564 HG13 HG12 ' A' ' 70' ' ' VAL . 67.7 t -60.98 -43.42 96.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.684 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -67.88 -35.9 79.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.67 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -72.26 -43.7 63.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.902 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.688 ' HB2' HG11 ' A' ' 70' ' ' VAL . 93.1 mt -65.12 -31.35 72.5 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.453 -178.77 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.402 ' HA ' HD23 ' A' ' 37' ' ' LEU . 11.8 mt -85.79 -0.68 55.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.222 -0.444 . . . . 0.0 112.086 -176.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -69.26 138.18 53.71 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.402 ' HA ' ' HG2' ' A' ' 42' ' ' ARG . 11.8 m -63.05 -30.5 71.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.843 0.354 . . . . 0.0 111.526 -175.265 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -69.34 -38.3 78.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.365 0.603 . . . . 0.0 110.39 175.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.7 t -79.24 -36.35 18.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.251 -172.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.402 ' HG2' ' HA ' ' A' ' 39' ' ' SER . 17.2 ptp180 -62.13 -20.28 63.91 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 120.859 0.361 . . . . 0.0 110.796 176.577 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 43' ' ' ARG . 40.7 ttm180 -85.21 -18.92 32.59 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.586 -178.51 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.602 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -89.13 168.38 15.54 Favored Pre-proline 0 CA--C 1.536 0.405 0 CA-C-N 116.85 -0.159 . . . . 0.0 110.989 -177.657 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.602 ' HD2' HG22 ' A' ' 44' ' ' THR . 49.2 Cg_endo -68.18 156.88 64.13 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.695 2.264 . . . . 0.0 111.975 176.339 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.451 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -68.12 -33.97 75.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.065 -177.491 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.531 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 20.6 m -58.28 -40.75 82.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.518 -177.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 54.7 m -59.84 -48.02 83.36 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.089 178.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.483 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 2.2 mttp -58.17 -48.8 79.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.21 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 58.3 t -64.02 -41.58 92.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.747 -175.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -65.12 -39.28 92.85 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.368 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -65.18 -48.81 72.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.48 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 85.0 mt -62.68 -39.56 94.32 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.045 -177.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -60.51 -42.83 97.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.021 0.439 . . . . 0.0 110.236 175.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 45.7 m -68.77 -19.71 64.32 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.827 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -80.83 -8.22 59.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.732 176.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.52 8.32 37.99 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.826 177.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.408 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 5.5 mp -80.07 144.72 32.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.252 0.549 . . . . 0.0 111.842 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.425 ' O ' HG13 ' A' ' 63' ' ' ILE . 6.1 m -86.46 165.42 16.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.37 174.202 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.25 -38.8 84.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.994 0.426 . . . . 0.0 110.929 -178.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -65.49 -37.55 87.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.909 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -67.1 -48.05 69.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.54 177.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.429 HG23 HD12 ' A' ' 53' ' ' LEU . 73.7 mt -59.31 -44.89 93.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.537 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.4 t -56.61 -43.35 80.07 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.788 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.704 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 32.5 tt0 -67.93 -48.31 66.3 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.925 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.484 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.25 -43.77 79.02 Favored 'General case' 0 CA--C 1.519 -0.24 0 O-C-N 123.147 0.279 . . . . 0.0 110.965 -178.399 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.562 ' O ' HG22 ' A' ' 70' ' ' VAL . 7.0 m-85 -58.57 -43.88 89.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.944 0.402 . . . . 0.0 110.954 177.568 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.8 m -65.96 -33.13 75.11 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.112 0.482 . . . . 0.0 110.618 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.704 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 25.2 mtpp -72.33 -30.35 64.68 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.91 -179.098 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.688 HG11 ' HB2' ' A' ' 36' ' ' LEU . 14.4 m -84.2 1.66 4.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.939 0.4 . . . . 0.0 111.201 -179.132 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.07 12.88 47.94 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.561 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -121.53 90.72 48.12 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.73 103.48 1.46 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 121.776 1.65 . . . . 0.0 112.001 -176.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.451 ' HE3' HG21 ' A' ' 46' ' ' THR . 71.3 mmtt -111.87 138.28 48.69 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.004 177.29 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 50.9 p -80.09 167.8 19.95 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.047 176.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.4 tp -63.56 -32.66 74.19 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -59.22 -45.46 91.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.832 176.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -56.31 -49.08 75.33 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.33 179.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 39.7 mm -63.45 -48.8 85.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.835 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -64.37 -39.63 94.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.41 -178.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -64.97 -44.69 88.54 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.116 0.484 . . . . 0.0 110.634 178.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.531 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 97.4 mt -65.48 -32.49 58.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.985 178.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 71.2 mt -79.36 -8.79 59.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.19 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 15.3 t . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.491 -0.766 . . . . 0.0 109.566 178.513 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.7 pttt . . . . . 0 CA--C 1.529 0.147 0 CA-C-O 120.433 0.159 . . . . 0.0 110.621 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.476 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 53.2 mtm180 -65.47 -48.0 74.17 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.705 0.288 . . . . 0.0 110.482 177.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.533 ' O ' HG23 ' A' ' 33' ' ' VAL . 76.5 t -61.74 -42.96 96.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.171 177.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.7 m -58.89 -45.66 89.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.908 178.385 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -62.0 -36.86 82.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.995 0.426 . . . . 0.0 111.135 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.75 -45.37 61.92 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.969 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 29' ' ' VAL . 90.6 t -61.22 -42.75 94.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.616 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.42 -35.82 76.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.168 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -71.21 -43.23 67.76 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.948 0.404 . . . . 0.0 110.553 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.721 ' HB2' HG11 ' A' ' 70' ' ' VAL . 88.9 mt -65.34 -29.19 69.89 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.284 179.21 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 37' ' ' LEU . 13.8 mt -85.67 6.35 27.98 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.261 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.693 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 13.4 t70 -79.72 133.56 36.35 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.661 -0.415 . . . . 0.0 109.939 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.5 m -52.96 -38.96 62.58 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 123.495 0.497 . . . . 0.0 112.044 -175.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -69.61 -36.68 76.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.128 0.49 . . . . 0.0 110.742 -179.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.526 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 61.5 t -76.8 -21.81 14.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.464 0.649 . . . . 0.0 110.385 -178.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.693 ' HG2' ' O ' ' A' ' 38' ' ' ASP . 20.4 mmm180 -64.08 -25.81 68.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.256 173.49 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -91.64 -17.98 24.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.542 -173.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.4 p -82.71 158.41 65.49 Favored Pre-proline 0 C--N 1.326 -0.447 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.123 -177.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -65.5 153.96 75.84 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.444 2.096 . . . . 0.0 111.754 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.57 -37.62 78.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.196 -177.08 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.513 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 18.9 m -58.76 -41.3 86.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.379 -177.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.6 m -63.57 -44.6 93.63 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.851 178.492 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.526 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 81.5 mttt -58.12 -48.26 80.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.398 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.451 HG12 HD21 ' A' ' 83' ' ' LEU . 85.2 t -66.96 -45.08 88.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.427 -176.122 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -64.38 -35.81 82.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.784 -177.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -67.14 -46.1 75.12 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.389 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 94.7 mt -64.25 -37.88 89.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.784 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.62 ' HD3' HD22 ' A' ' 83' ' ' LEU . 29.6 ttpt -63.26 -39.31 94.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.02 0.438 . . . . 0.0 109.94 176.25 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 44.3 m -68.71 -15.77 63.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.91 179.143 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -85.24 -4.08 59.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.613 175.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.09 1.68 55.94 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.854 -0.688 . . . . 0.0 112.694 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.476 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.4 mp -71.67 148.55 46.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.099 0.476 . . . . 0.0 111.364 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.464 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 9.4 m -90.79 165.98 13.36 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.286 175.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.86 -39.55 78.04 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.677 0.275 . . . . 0.0 111.683 -177.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -67.76 -35.07 78.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.39 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.464 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 4.1 mm-40 -64.96 -45.2 86.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.473 0.654 . . . . 0.0 109.48 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 67.8 mt -62.81 -42.1 95.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.291 177.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 32.1 t -56.8 -46.64 81.46 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.343 177.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -67.67 -48.13 67.5 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.712 -178.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.546 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.81 -45.76 82.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.295 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.549 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.1 m-85 -57.49 -45.1 85.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.898 0.38 . . . . 0.0 111.241 178.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.3 m -65.14 -33.23 75.52 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.94 0.4 . . . . 0.0 110.431 -177.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.514 ' HE3' HG21 ' A' ' 33' ' ' VAL . 21.3 mtmt -72.1 -27.73 62.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.607 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.721 HG11 ' HB2' ' A' ' 36' ' ' LEU . 8.4 m -88.79 7.49 3.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.736 0.303 . . . . 0.0 111.657 -179.024 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 93.05 17.21 44.48 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.743 176.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -127.22 91.08 47.38 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -68.19 105.72 1.25 Allowed 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 122.006 1.804 . . . . 0.0 112.195 -176.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -116.41 139.12 50.77 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.836 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 21.6 p -87.46 167.59 13.85 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.302 176.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 51.6 tp -63.63 -33.35 75.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.19 0.519 . . . . 0.0 109.676 176.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -57.77 -45.73 85.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.692 177.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -57.73 -48.36 79.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.994 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 36.5 mm -63.72 -46.02 95.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.813 -175.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -60.96 -43.05 99.31 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.07 0.462 . . . . 0.0 110.298 177.027 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.5 tpp180 -60.05 -45.12 93.89 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.434 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.513 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 86.9 mt -67.39 -35.07 72.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.964 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.62 HD22 ' HD3' ' A' ' 54' ' ' LYS . 84.3 mt -82.1 -0.18 43.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.382 179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 50.7 m . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.581 -0.723 . . . . 0.0 110.131 175.71 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt . . . . . 0 CA--C 1.523 -0.088 0 CA-C-O 120.527 0.203 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.579 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 60.2 mtm180 -63.84 -45.36 89.86 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.704 0.287 . . . . 0.0 110.626 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.487 ' O ' HG23 ' A' ' 33' ' ' VAL . 85.0 t -64.31 -41.44 92.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.415 177.184 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.4 m -62.08 -42.98 99.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.247 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -61.91 -35.65 79.0 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.172 0.51 . . . . 0.0 110.652 176.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.35 -44.91 61.93 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.243 179.312 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.493 HG13 HG12 ' A' ' 70' ' ' VAL . 71.5 t -60.87 -43.23 95.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.861 0.362 . . . . 0.0 110.527 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -68.31 -36.0 78.67 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.728 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 92.9 t80 -72.09 -44.17 63.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.841 0.353 . . . . 0.0 110.634 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.673 ' HB2' HG11 ' A' ' 70' ' ' VAL . 86.3 mt -62.74 -31.16 72.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.491 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 37' ' ' LEU . 14.0 mt -85.95 3.16 43.3 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -176.336 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.608 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 13.5 t70 -78.99 138.17 37.93 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.061 178.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.7 m -57.21 -38.07 73.17 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -176.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.5 ptp180 -68.6 -32.81 72.96 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.544 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 66.6 t -79.43 -31.16 14.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.261 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.608 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 86.9 mtt180 -61.82 -26.72 68.29 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.224 0.535 . . . . 0.0 109.646 173.048 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.445 ' HA ' ' NE ' ' A' ' 43' ' ' ARG . 6.8 tpm_? -85.71 -19.21 31.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.515 -178.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.1 p -82.6 155.18 68.67 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 122.057 -0.402 . . . . 0.0 110.688 178.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.421 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 35.3 Cg_endo -66.63 157.13 62.4 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.444 2.096 . . . . 0.0 111.777 175.261 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.413 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -59.65 -34.98 73.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.88 -178.076 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.7 p -58.58 -43.5 89.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.229 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 71.1 m -65.24 -44.37 88.42 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.846 179.155 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.554 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 81.3 mttt -57.35 -49.64 75.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.123 -179.239 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 46' ' ' THR . 64.7 t -66.22 -42.52 91.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.005 -176.419 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 24.9 m170 -64.73 -42.63 95.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.159 -178.674 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -66.12 -41.74 90.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.412 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 81.2 mt -63.05 -40.68 98.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.869 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.402 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 49.5 tptt -60.92 -40.84 94.73 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.103 0.478 . . . . 0.0 110.015 175.563 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.0 t -67.46 -20.08 65.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.907 178.376 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -81.11 5.76 15.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.232 178.107 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.04 12.62 58.72 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.58 177.059 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.579 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.5 mp -83.34 170.11 14.92 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.523 0.678 . . . . 0.0 111.804 179.748 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.442 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 16.8 m -117.71 164.28 15.22 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.78 -1.1 . . . . 0.0 108.562 173.036 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.08 -35.93 72.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.732 0.301 . . . . 0.0 111.685 -175.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.1 mp0 -69.07 -37.27 78.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.054 0.454 . . . . 0.0 110.703 -177.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.442 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 1.5 mm-40 -68.44 -44.34 75.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.505 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 75.9 mt -62.5 -41.58 92.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.438 179.175 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 49.7 t -56.71 -42.99 80.14 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.99 178.845 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.691 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 26.9 tt0 -68.27 -48.4 65.13 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.52 179.311 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.467 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.0 -44.69 78.88 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.277 -177.652 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.526 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.2 m-85 -57.73 -42.81 84.63 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.902 0.382 . . . . 0.0 111.123 177.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.1 m -66.69 -33.12 74.93 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.331 0.586 . . . . 0.0 110.588 -178.155 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.691 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 25.2 mtpp -71.87 -31.95 66.96 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.471 -178.641 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.673 HG11 ' HB2' ' A' ' 36' ' ' LEU . 11.7 m -82.7 -3.91 7.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.813 0.339 . . . . 0.0 111.08 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 101.73 16.46 24.04 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.8 177.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -123.92 91.39 49.69 Favored Pre-proline 0 C--N 1.322 -0.622 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -71.43 101.61 1.16 Allowed 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 122.033 1.822 . . . . 0.0 112.115 -176.496 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -108.37 147.93 30.84 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.489 177.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 43.1 p -85.47 162.43 18.96 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.001 175.311 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.4 tp -63.64 -33.17 75.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.265 0.555 . . . . 0.0 109.714 177.366 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -61.83 -42.36 98.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.55 178.023 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.418 ' O ' HG13 ' A' ' 82' ' ' ILE . 24.5 mm-40 -56.03 -49.6 73.24 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.593 177.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.7 mm -62.72 -49.69 82.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.965 -174.552 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -64.14 -39.29 93.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.892 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 18.3 tpp180 -64.28 -45.14 89.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.94 178.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 78' ' ' GLU . 96.8 mt -63.15 -34.11 64.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.847 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.7 mt -77.0 -20.8 55.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.255 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 47.3 m . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.885 -0.578 . . . . 0.0 110.481 -179.033 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt . . . . . 0 CA--C 1.526 0.045 0 CA-C-O 120.411 0.148 . . . . 0.0 110.925 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.533 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 63.2 mtm180 -64.72 -48.37 74.87 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 120.922 0.392 . . . . 0.0 109.956 177.174 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.564 ' O ' HG23 ' A' ' 33' ' ' VAL . 86.0 t -60.7 -42.55 92.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.185 176.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.5 t -58.93 -45.9 89.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.028 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -61.26 -36.19 79.34 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.006 0.432 . . . . 0.0 110.668 178.648 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.32 -44.58 62.48 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.048 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 29' ' ' VAL . 92.7 t -60.96 -43.51 96.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.799 0.333 . . . . 0.0 110.536 -179.29 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -68.76 -34.5 75.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.982 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -72.94 -43.37 62.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.061 0.457 . . . . 0.0 110.711 178.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.691 ' HB2' HG11 ' A' ' 70' ' ' VAL . 84.2 mt -65.66 -29.44 70.0 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.602 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.5 mt -84.18 6.36 22.84 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.585 -177.205 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.492 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 22.9 t70 -83.57 136.76 34.13 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.874 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.1 t -53.8 -43.68 69.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.038 -177.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -68.55 -42.67 78.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.157 0.503 . . . . 0.0 110.396 -177.41 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.502 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 86.9 t -66.94 -34.54 70.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.034 -179.171 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.492 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 83.9 mtp180 -67.19 -22.94 65.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.247 177.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 57.8 ttp180 -84.3 -18.12 37.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.751 0.31 . . . . 0.0 110.936 -178.386 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -85.73 158.68 56.35 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.66 -0.246 . . . . 0.0 110.709 175.496 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.45 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 31.7 Cg_endo -65.43 157.04 60.21 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 122.671 2.247 . . . . 0.0 112.574 -179.472 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.476 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.5 OUTLIER -60.37 -40.26 90.19 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.055 -177.411 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 11.0 m -58.12 -42.43 85.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.913 -177.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.43 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 56.4 m -62.75 -45.47 92.57 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.885 178.102 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.509 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 81.3 mttt -57.07 -49.37 76.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.996 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 46' ' ' THR . 99.6 t -64.77 -43.19 96.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.064 -176.363 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 29.0 m170 -64.45 -37.97 89.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.962 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.453 ' CE1' ' HE2' ' A' ' 56' ' ' LYS . 43.8 t80 -70.17 -42.77 72.02 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.514 -178.648 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 89.9 mt -64.0 -34.76 78.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.952 0.406 . . . . 0.0 110.801 178.558 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.447 ' HE3' ' HB3' ' A' ' 54' ' ' LYS . 0.5 OUTLIER -60.73 -43.5 97.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.336 175.199 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 45.8 m -69.79 -13.76 62.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.086 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 65.6 mttm -78.85 -8.18 58.58 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.315 174.556 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.4 20.72 28.99 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.047 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.533 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.7 mp -86.55 154.8 20.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.07 0.462 . . . . 0.0 111.254 178.711 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.512 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 13.1 m -93.84 161.87 14.15 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.19 174.408 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.24 -35.23 71.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.22 0.533 . . . . 0.0 110.875 -179.07 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -67.9 -38.89 83.54 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.527 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.512 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 4.2 mm-40 -65.89 -44.88 84.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.978 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 75.1 mt -62.04 -43.81 98.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.368 178.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 39.7 t -57.45 -44.17 84.54 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.753 176.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 70.1 tt0 -67.21 -47.28 71.33 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.838 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.514 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -57.45 -47.84 80.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.259 -179.456 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.596 ' O ' HG22 ' A' ' 70' ' ' VAL . 6.2 m-85 -57.05 -44.54 83.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.988 0.423 . . . . 0.0 111.087 178.779 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.1 m -65.09 -32.77 74.64 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.996 0.427 . . . . 0.0 110.626 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.471 ' HE3' HG21 ' A' ' 33' ' ' VAL . 19.1 mtmt -71.27 -31.7 67.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.75 179.069 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.691 HG11 ' HB2' ' A' ' 36' ' ' LEU . 11.0 m -82.29 -3.55 7.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-O 120.859 0.362 . . . . 0.0 111.439 -177.334 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 100.12 17.19 25.68 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.261 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.405 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 5.5 tp-100 -126.68 91.15 48.0 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -72.73 99.24 1.04 Allowed 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 121.706 1.604 . . . . 0.0 112.239 -176.414 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.476 ' HE3' HG21 ' A' ' 46' ' ' THR . 73.3 mmtt -107.59 137.37 45.74 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.193 175.447 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.452 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 76.7 p -80.69 159.41 25.29 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.398 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.418 ' HG ' ' HE2' ' A' ' 80' ' ' LYS . 52.6 tp -61.42 -33.22 73.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.813 178.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -61.16 -43.58 98.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.917 178.154 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.452 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 21.6 mm-40 -59.13 -49.71 76.84 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.608 178.439 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 45.1 mm -62.66 -44.14 99.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.189 -174.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.418 ' HE2' ' HG ' ' A' ' 76' ' ' LEU . 61.6 mttm -63.89 -38.62 91.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.807 0.337 . . . . 0.0 110.927 -179.705 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 18.3 tpt180 -67.73 -44.48 77.51 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.775 177.531 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 78' ' ' GLU . 90.7 mt -62.16 -37.82 79.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.874 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.432 HD21 HG12 ' A' ' 50' ' ' VAL . 81.4 mt -78.21 -25.85 47.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.551 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 C--O 1.252 1.191 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.691 -178.556 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 pttp . . . . . 0 N--CA 1.457 -0.108 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.476 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 39.8 mtm180 -66.05 -47.03 75.7 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.762 0.315 . . . . 0.0 110.523 179.233 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.498 ' O ' HG23 ' A' ' 33' ' ' VAL . 82.3 t -61.26 -42.68 94.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.215 177.098 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 35.8 m -58.69 -46.44 87.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.801 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -61.67 -36.0 79.58 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.083 0.468 . . . . 0.0 111.069 179.19 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.62 -44.41 62.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.006 179.526 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.517 HG13 HG12 ' A' ' 70' ' ' VAL . 75.6 t -60.82 -43.24 95.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.845 0.355 . . . . 0.0 110.575 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -69.22 -34.04 74.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.019 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -72.43 -43.52 63.71 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.885 0.374 . . . . 0.0 110.775 178.021 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.663 ' HB2' HG11 ' A' ' 70' ' ' VAL . 88.9 mt -66.51 -31.45 72.19 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.702 -177.344 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.6 mt -85.98 6.83 26.88 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.83 0.347 . . . . 0.0 111.918 -177.128 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.481 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 14.3 t70 -77.58 135.88 38.21 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 176.212 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.7 m -57.8 -36.17 71.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.74 0.305 . . . . 0.0 111.698 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -69.21 -41.56 76.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.196 0.522 . . . . 0.0 110.612 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.491 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 88.8 t -72.37 -32.93 44.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.876 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.481 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 24.6 mtp180 -66.08 -21.62 66.38 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.577 175.422 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -80.99 -17.88 48.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.132 -177.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -92.02 158.72 39.13 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.132 178.067 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.415 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 32.8 Cg_endo -64.82 156.9 59.27 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.885 2.39 . . . . 0.0 112.347 178.318 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.489 HG21 ' HE3' ' A' ' 74' ' ' LYS . 1.1 m -65.7 -38.08 88.23 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.599 -174.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.3 m -58.69 -38.43 78.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.951 0.405 . . . . 0.0 110.731 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 75.5 m -65.88 -44.25 85.92 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.827 176.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.491 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 86.8 mttt -57.27 -47.74 80.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.546 178.322 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 46' ' ' THR . 82.3 t -63.87 -46.1 95.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.167 -177.688 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -64.16 -37.21 86.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.983 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -64.08 -47.23 80.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.463 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 96.2 mt -64.04 -37.07 86.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.942 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -59.29 -43.26 92.57 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.13 0.49 . . . . 0.0 110.436 176.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.4 m -70.52 -16.6 62.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.505 -179.38 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.4 mmtp -85.41 -4.32 59.12 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 120.781 0.324 . . . . 0.0 111.199 177.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.81 13.71 31.27 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.73 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.476 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.0 mp -87.31 149.88 24.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.189 0.518 . . . . 0.0 111.709 178.059 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.44 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 16.8 m -94.04 167.63 11.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.519 175.44 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.73 -38.16 80.92 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -177.237 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -65.89 -37.51 86.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.112 0.482 . . . . 0.0 110.406 -179.078 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.44 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 3.1 mm-40 -64.46 -47.45 78.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.682 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.76 -45.47 98.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.627 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 53.7 t -58.13 -44.71 87.95 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.168 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.636 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 29.9 tt0 -67.48 -48.32 67.48 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.663 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.498 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.65 -44.02 80.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.458 -178.149 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.549 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.4 m-85 -58.53 -41.85 86.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.974 0.416 . . . . 0.0 111.207 179.057 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.8 m -65.77 -34.22 77.67 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.233 0.539 . . . . 0.0 110.422 -177.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.636 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 4.4 mtpm? -71.46 -31.2 66.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.957 179.249 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.663 HG11 ' HB2' ' A' ' 36' ' ' LEU . 11.0 m -83.48 4.13 2.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.811 0.338 . . . . 0.0 111.23 -178.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 94.02 17.45 40.6 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.606 176.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -127.1 91.55 46.42 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.477 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -70.28 98.26 0.73 Allowed 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 121.748 1.632 . . . . 0.0 112.328 -177.294 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.489 ' HE3' HG21 ' A' ' 46' ' ' THR . 71.6 mmtt -106.61 140.19 39.87 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.799 177.653 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 30.6 p -86.06 156.57 20.35 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.26 178.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 37.5 tp -62.42 -32.3 73.12 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -56.81 -45.48 82.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.501 176.116 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.419 ' O ' HG13 ' A' ' 82' ' ' ILE . 33.0 mt-10 -61.79 -48.76 79.18 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.71 177.33 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 46.4 mm -60.29 -46.27 95.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.839 -176.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -63.02 -38.06 89.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.948 178.848 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.1 tpp180 -67.9 -44.15 77.64 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.697 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 78' ' ' GLU . 93.6 mt -64.67 -36.49 77.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.845 -179.688 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.7 mt -78.98 -25.27 43.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.328 178.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 C--O 1.252 1.203 0 CA-C-O 119.053 -0.499 . . . . 0.0 110.578 -176.903 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? . . . . . 0 N--CA 1.457 -0.107 0 CA-C-O 120.595 0.236 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.503 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 35.2 mtm180 -67.21 -44.5 79.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.402 177.444 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.628 ' O ' HG23 ' A' ' 33' ' ' VAL . 87.5 t -61.1 -46.84 95.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.156 177.552 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.1 m -62.4 -43.77 98.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.343 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -61.78 -36.04 79.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.124 0.488 . . . . 0.0 110.537 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.468 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -69.94 -43.89 70.69 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.584 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.628 HG23 ' O ' ' A' ' 29' ' ' VAL . 90.3 t -60.32 -46.23 95.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.011 0.434 . . . . 0.0 110.393 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.89 -33.7 74.2 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.26 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -72.1 -43.7 64.37 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.787 0.327 . . . . 0.0 110.789 177.551 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.711 ' HB2' HG11 ' A' ' 70' ' ' VAL . 95.1 mt -65.02 -31.3 72.46 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.213 -179.058 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 37' ' ' LEU . 16.5 mt -85.84 5.84 30.9 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.991 -177.025 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.61 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 10.6 t70 -74.28 134.0 42.62 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 177.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 m -52.15 -36.7 52.24 Favored 'General case' 0 C--N 1.328 -0.365 0 O-C-N 123.386 0.428 . . . . 0.0 111.652 -176.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 84.5 mtm180 -68.86 -44.42 73.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.181 0.515 . . . . 0.0 110.978 178.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.529 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.3 t -70.96 -26.69 28.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.681 -176.57 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.61 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 52.1 mtt180 -62.39 -22.49 66.19 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.421 174.327 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -90.27 -18.4 25.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.73 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.1 p -81.57 152.71 70.21 Favored Pre-proline 0 C--N 1.326 -0.433 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.63 177.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.416 ' HG2' ' OG ' ' A' ' 48' ' ' SER . 26.4 Cg_endo -63.8 154.53 69.06 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.309 2.006 . . . . 0.0 111.912 177.706 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.417 ' O ' HG23 ' A' ' 50' ' ' VAL . 1.5 m -59.5 -39.54 84.16 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.249 -177.401 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.418 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 13.8 m -58.26 -42.26 86.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.843 -179.038 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.416 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 74.4 m -62.47 -44.27 96.81 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.152 178.184 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.529 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 84.7 mttt -57.65 -49.97 74.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.26 179.345 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.584 HG12 HD21 ' A' ' 83' ' ' LEU . 61.6 t -64.69 -40.96 90.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.113 -176.853 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 36.7 m170 -64.92 -38.37 90.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.903 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -64.68 -47.0 80.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.885 0.374 . . . . 0.0 110.359 179.202 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.477 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 90.1 mt -62.59 -37.68 87.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.134 -179.076 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.607 ' HD3' HD22 ' A' ' 83' ' ' LEU . 38.3 ttpt -60.74 -42.19 96.85 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.313 0.578 . . . . 0.0 110.029 175.048 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.6 t -63.19 -24.77 68.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.811 178.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -85.1 7.21 22.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.391 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.8 7.94 70.43 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.623 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.503 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.4 mp -75.85 147.74 38.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.349 0.595 . . . . 0.0 111.125 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.504 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 14.9 m -91.2 162.9 14.45 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.786 174.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.01 -35.93 71.95 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.99 0.424 . . . . 0.0 111.14 -177.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -63.91 -41.61 97.62 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.247 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.504 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 3.1 mm-40 -63.63 -45.63 89.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.422 0.63 . . . . 0.0 109.543 -178.872 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.436 HG23 HD12 ' A' ' 53' ' ' LEU . 63.2 mt -62.99 -43.65 99.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.709 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 40.3 t -56.59 -46.18 80.96 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.139 178.845 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -68.01 -47.68 67.79 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.698 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.561 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.92 -46.31 82.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.902 -179.421 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.576 ' O ' HG22 ' A' ' 70' ' ' VAL . 2.6 m-85 -57.21 -45.72 83.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.247 179.316 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.9 m -65.25 -33.46 76.04 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.436 -177.626 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.496 ' HE3' HG21 ' A' ' 33' ' ' VAL . 25.9 mtmt -72.63 -27.04 61.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.996 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.711 HG11 ' HB2' ' A' ' 36' ' ' LEU . 8.6 m -87.05 3.45 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-O 120.841 0.353 . . . . 0.0 111.217 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 94.56 15.77 45.4 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.571 -0.824 . . . . 0.0 112.623 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -124.17 91.58 49.39 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -71.71 99.79 0.99 Allowed 'Trans proline' 0 N--CA 1.455 -0.758 0 C-N-CA 121.997 1.798 . . . . 0.0 112.332 -176.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -113.12 140.94 47.47 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.922 176.206 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 33.2 p -82.93 167.91 17.54 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.596 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 60.5 tp -63.0 -33.86 76.32 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 174.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -62.23 -43.63 98.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.458 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -57.06 -48.58 78.22 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.818 178.544 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.9 mm -61.33 -48.88 86.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.825 -176.174 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -64.64 -35.38 80.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.846 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.8 tpt180 -61.98 -45.77 92.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.247 0.546 . . . . 0.0 110.348 175.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.418 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 78.4 mt -68.1 -33.96 63.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.172 -178.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.607 HD22 ' HD3' ' A' ' 54' ' ' LYS . 87.5 mt -81.79 -20.68 38.66 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.906 178.293 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 71.5 m . . . . . 0 C--O 1.252 1.223 0 CA-C-O 117.963 -1.018 . . . . 0.0 111.684 179.236 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt . . . . . 0 CA--C 1.527 0.077 0 CA-C-O 120.54 0.209 . . . . 0.0 110.546 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.5 mtm-85 -68.45 -41.24 80.55 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.571 ' O ' HG23 ' A' ' 33' ' ' VAL . 69.2 t -60.91 -44.87 98.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.303 -0.408 . . . . 0.0 109.994 174.308 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.1 m -58.77 -42.2 88.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.021 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.512 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 23.3 m-80 -66.48 -34.76 78.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.051 0.453 . . . . 0.0 110.994 177.153 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.59 -43.99 65.27 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.108 177.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 29' ' ' VAL . 94.4 t -61.25 -40.93 87.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.847 0.356 . . . . 0.0 110.752 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 12.3 pt-20 -68.94 -37.49 78.91 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.563 178.876 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -72.28 -43.53 64.12 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.161 -179.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.592 ' HB2' HG11 ' A' ' 70' ' ' VAL . 74.0 mt -65.1 -31.68 73.0 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.45 -179.165 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.3 mt -85.79 6.48 27.79 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -176.447 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -76.87 139.05 40.13 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 177.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.411 ' HA ' ' HG2' ' A' ' 42' ' ' ARG . 20.9 t -59.45 -31.78 69.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.85 0.357 . . . . 0.0 111.057 -178.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -68.53 -42.69 78.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.372 0.606 . . . . 0.0 110.549 178.873 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 93.6 t -79.52 -32.26 14.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.271 -171.713 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.411 ' HG2' ' HA ' ' A' ' 39' ' ' SER . 17.3 ptp180 -67.92 -22.2 65.08 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.118 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -83.98 -18.09 38.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.72 0.295 . . . . 0.0 111.496 -178.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.09 162.93 50.35 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 116.638 -0.256 . . . . 0.0 110.756 177.231 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -63.97 157.9 50.33 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.626 2.217 . . . . 0.0 112.376 179.195 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.419 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -62.69 -35.18 78.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.075 -178.388 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.556 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 14.6 p -58.73 -43.66 90.26 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.402 -178.71 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.3 m -61.12 -45.93 92.68 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.965 178.572 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.465 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 82.0 mttt -57.34 -50.3 73.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.564 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 92.1 t -65.57 -44.91 93.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.201 -174.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 27.3 m170 -64.48 -35.99 82.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.005 -177.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -70.19 -38.53 75.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.277 -178.235 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 82.5 mt -69.83 -37.62 76.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.699 178.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -62.56 -38.26 89.34 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.162 0.506 . . . . 0.0 109.851 174.29 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.5 t -67.1 -19.96 65.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.441 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 69.0 mmtt -80.81 -8.37 59.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.768 177.232 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.07 15.67 38.08 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.601 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.9 mp -80.94 145.56 31.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.104 0.478 . . . . 0.0 111.402 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.2 m -82.28 163.46 21.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.539 173.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.73 -41.1 85.63 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.843 0.354 . . . . 0.0 111.246 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -70.55 -30.37 67.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.393 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -66.97 -45.73 76.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.225 0.535 . . . . 0.0 109.941 175.518 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 64.7 mt -62.67 -43.09 98.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.232 177.297 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 43.9 t -56.76 -43.62 80.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.836 176.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.98 -48.56 65.46 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.824 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.1 -42.62 81.09 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.281 -179.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.464 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.3 m-85 -60.8 -47.57 85.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.917 177.601 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 21.8 m -64.07 -34.96 79.21 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.04 0.448 . . . . 0.0 110.255 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mmmt -62.79 -35.39 79.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.602 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.592 HG11 ' HB2' ' A' ' 36' ' ' LEU . 22.4 m -87.42 7.23 2.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -176.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.6 18.39 48.64 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.657 177.439 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -123.75 90.97 50.18 Favored Pre-proline 0 C--N 1.322 -0.613 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 177.048 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -71.92 97.71 0.84 Allowed 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 121.903 1.736 . . . . 0.0 112.437 -176.032 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.419 ' HE3' HG21 ' A' ' 46' ' ' THR . 69.3 mmtt -106.97 137.96 44.06 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.848 176.119 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.7 p -80.64 162.05 24.4 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.409 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 64.7 tp -61.42 -33.61 74.0 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 175.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -60.18 -44.32 95.14 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.365 176.561 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.441 ' O ' HG13 ' A' ' 82' ' ' ILE . 8.7 mm-40 -61.21 -47.3 86.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.125 177.426 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.8 mm -60.13 -47.44 91.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.888 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -62.42 -40.85 97.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.13 0.491 . . . . 0.0 110.548 177.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -59.89 -47.02 87.45 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.747 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.556 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 88.8 mt -66.72 -31.64 54.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.09 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.1 mt -77.73 -12.57 59.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.204 178.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 25.9 p . . . . . 0 C--O 1.252 1.187 0 CA-C-O 119.036 -0.507 . . . . 0.0 110.577 177.305 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt . . . . . 0 N--CA 1.456 -0.155 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.483 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 34.8 mtm180 -63.19 -46.31 87.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 0.0 110.506 178.149 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.575 ' O ' HG23 ' A' ' 33' ' ' VAL . 97.9 t -61.74 -46.76 95.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.589 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.1 p -62.0 -38.51 88.88 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.247 -0.181 . . . . 0.0 111.428 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -61.15 -41.14 96.21 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.23 0.538 . . . . 0.0 110.37 176.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.69 -44.84 63.52 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.117 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.575 HG23 ' O ' ' A' ' 29' ' ' VAL . 87.0 t -61.49 -42.14 92.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.745 -179.225 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -69.23 -36.13 76.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.644 0.259 . . . . 0.0 110.829 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -71.97 -43.8 64.58 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.875 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.699 ' HB2' HG11 ' A' ' 70' ' ' VAL . 86.9 mt -65.74 -29.98 70.57 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.538 -178.756 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.509 ' HG ' HG12 ' A' ' 70' ' ' VAL . 12.2 mt -85.13 6.32 26.11 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -176.204 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.491 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 25.6 t70 -79.51 138.71 37.62 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.348 177.764 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.441 ' O ' ' HG2' ' A' ' 43' ' ' ARG . 23.1 m -57.04 -41.57 78.87 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -176.571 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.9 mmp_? -68.71 -38.55 80.34 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.087 0.47 . . . . 0.0 110.206 179.54 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.4 ' O ' ' NZ ' ' A' ' 49' ' ' LYS . 61.9 t -71.64 -25.15 24.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.387 179.109 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.491 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 71.0 mtp180 -72.75 -20.53 61.17 Favored 'General case' 0 C--N 1.319 -0.738 0 O-C-N 122.051 -0.406 . . . . 0.0 110.895 172.866 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.441 ' HG2' ' O ' ' A' ' 39' ' ' SER . 32.4 mmm180 -96.18 10.73 36.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.738 -177.596 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.502 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -110.12 168.08 8.15 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.677 178.249 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.502 ' HD2' HG22 ' A' ' 44' ' ' THR . 57.9 Cg_endo -70.73 156.26 61.14 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.425 2.083 . . . . 0.0 111.71 175.332 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.45 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -67.21 -34.01 76.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.898 0.38 . . . . 0.0 111.067 -177.138 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.489 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 11.5 p -58.39 -42.16 86.49 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.513 -176.733 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.9 m -61.6 -42.33 98.71 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.877 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.496 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 21.1 mttm -63.97 -47.41 80.5 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.654 -178.116 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.482 HG12 HD21 ' A' ' 83' ' ' LEU . 68.5 t -63.82 -44.41 98.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.743 -175.917 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -65.11 -40.52 94.64 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.743 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -62.53 -47.36 84.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.586 178.646 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 89.9 mt -64.58 -36.47 84.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.982 -178.624 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.481 ' HD2' HD22 ' A' ' 83' ' ' LEU . 78.9 tttt -64.3 -38.12 89.91 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 120.929 0.395 . . . . 0.0 110.241 176.509 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.2 t -66.68 -25.19 66.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.058 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.7 mmtt -78.12 -4.29 46.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.078 178.396 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.8 8.46 54.26 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.457 178.124 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.483 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.8 mp -80.43 146.62 31.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.454 0.645 . . . . 0.0 111.333 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.3 m -89.41 165.74 14.16 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.328 175.194 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.0 -37.27 76.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.962 0.41 . . . . 0.0 110.958 -178.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -64.13 -42.5 96.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.708 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -64.11 -44.81 91.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.38 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.45 HG23 HD12 ' A' ' 53' ' ' LEU . 77.2 mt -61.51 -42.89 95.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.299 178.065 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 43.5 t -57.88 -46.0 85.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.967 177.813 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -68.11 -45.11 74.6 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.247 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.44 -41.74 81.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.61 0.243 . . . . 0.0 111.207 -178.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.482 ' O ' HG22 ' A' ' 70' ' ' VAL . 8.9 m-85 -61.48 -46.33 90.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.052 0.453 . . . . 0.0 110.595 176.247 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 20.2 m -63.25 -32.84 74.35 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.089 0.471 . . . . 0.0 110.402 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 12.7 mmmt -66.74 -33.37 75.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.882 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.699 HG11 ' HB2' ' A' ' 36' ' ' LEU . 22.0 m -87.22 -0.17 7.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.729 0.299 . . . . 0.0 111.632 -177.428 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 99.27 16.29 30.29 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.579 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -122.86 91.43 49.73 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 178.364 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -70.84 100.57 0.96 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 121.786 1.657 . . . . 0.0 112.125 -177.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.45 ' HE3' HG21 ' A' ' 46' ' ' THR . 67.5 mmtt -105.22 142.6 34.71 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.679 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 41.6 p -83.12 156.01 23.51 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.289 178.1 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.87 -32.56 73.83 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 177.074 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.5 t30 -58.28 -45.78 87.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.748 177.367 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -59.3 -46.68 87.91 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.189 179.527 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 41.6 mm -60.3 -45.47 96.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.524 -177.515 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -64.29 -39.85 94.77 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.015 0.436 . . . . 0.0 110.858 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 64.5 ttt180 -60.11 -46.56 89.21 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.548 177.302 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.489 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 89.8 mt -67.35 -31.94 55.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.305 -0.862 . . . . 0.0 111.298 -179.377 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.482 HD21 HG12 ' A' ' 50' ' ' VAL . 90.4 mt -83.14 -14.25 53.95 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.332 179.001 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 21.8 p . . . . . 0 C--O 1.25 1.103 0 C-N-CA 123.653 0.781 . . . . 0.0 111.76 -179.242 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.9 pttm . . . . . 0 N--CA 1.454 -0.238 0 CA-C-O 120.325 0.107 . . . . 0.0 110.953 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.449 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 25.0 mtm180 -67.64 -48.1 67.69 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.772 0.32 . . . . 0.0 110.398 178.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.593 ' O ' HG23 ' A' ' 33' ' ' VAL . 98.3 t -60.94 -39.95 83.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.821 176.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.8 t -58.37 -45.45 88.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.502 178.006 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.441 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 93.3 m-20 -62.59 -37.74 87.43 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.733 178.564 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.66 -45.04 63.17 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.414 -179.375 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.593 HG23 ' O ' ' A' ' 29' ' ' VAL . 93.1 t -61.16 -41.91 91.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.87 0.367 . . . . 0.0 110.654 -178.741 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 10.4 pt-20 -68.93 -37.5 78.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.713 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -71.6 -43.01 67.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.936 0.398 . . . . 0.0 110.841 -179.462 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.672 ' HB2' HG11 ' A' ' 70' ' ' VAL . 84.0 mt -65.01 -30.39 71.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.577 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.3 mt -85.18 7.03 23.32 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -176.482 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.496 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 11.3 t70 -80.12 135.95 36.42 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 176.631 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.457 ' O ' ' HG3' ' A' ' 43' ' ' ARG . 15.4 p -57.12 -36.95 71.27 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.871 0.367 . . . . 0.0 111.48 -176.837 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 80.7 mtm180 -68.58 -38.96 81.11 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.273 0.559 . . . . 0.0 110.262 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 57.9 t -78.5 -25.03 13.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.228 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 79.7 mtp180 -72.69 -33.12 66.27 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.72 -0.392 . . . . 0.0 112.043 178.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 39' ' ' SER . 77.1 mtp180 -81.32 -10.25 59.6 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -173.044 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.522 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -79.41 173.54 7.56 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.76 -0.2 . . . . 0.0 110.632 177.087 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.522 ' HD2' HG22 ' A' ' 44' ' ' THR . 46.4 Cg_endo -68.62 155.65 68.19 Favored 'Trans proline' 0 C--O 1.239 0.54 0 C-N-CA 121.941 1.761 . . . . 0.0 111.249 171.003 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.37 -33.69 74.72 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.812 0.339 . . . . 0.0 111.019 -177.82 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.457 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 15.4 p -57.78 -42.64 84.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.259 -176.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.1 m -62.1 -43.82 97.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.111 -179.7 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -62.05 -47.43 84.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.476 -177.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 76.6 t -64.53 -43.52 96.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.73 -177.507 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 37.8 m170 -64.87 -37.71 88.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.504 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -63.86 -51.24 65.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.436 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.412 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 91.6 mt -62.24 -36.28 81.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.063 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.19 -43.42 95.92 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.23 0.538 . . . . 0.0 110.309 176.566 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.2 t -70.68 -14.21 62.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.238 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -86.73 0.75 54.11 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.843 0.354 . . . . 0.0 110.925 177.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.65 10.32 50.49 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.475 177.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.449 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.8 mp -88.56 148.02 24.31 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.372 0.606 . . . . 0.0 111.119 178.556 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.401 ' O ' HG13 ' A' ' 63' ' ' ILE . 50.9 m -95.28 173.13 7.7 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.942 -1.027 . . . . 0.0 109.771 176.085 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.83 87.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.924 0.392 . . . . 0.0 111.313 -177.513 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -67.58 -35.51 79.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.261 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -64.17 -45.98 86.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.459 0.647 . . . . 0.0 109.51 178.024 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 59' ' ' SER . 64.4 mt -65.19 -43.65 95.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.816 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 53.2 t -57.36 -43.22 83.32 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.915 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.47 -48.62 66.65 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.762 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.495 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -57.2 -47.62 80.81 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.198 -178.797 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.552 ' O ' HG22 ' A' ' 70' ' ' VAL . 5.1 m-85 -56.93 -45.83 82.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.278 179.115 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.6 m -64.91 -33.14 75.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.965 0.412 . . . . 0.0 110.584 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.1 mtmt -70.56 -31.62 68.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.973 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.672 HG11 ' HB2' ' A' ' 36' ' ' LEU . 14.3 m -83.68 -3.78 7.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.836 0.35 . . . . 0.0 111.457 -176.75 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 101.14 18.49 19.48 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.339 178.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -126.87 91.39 47.21 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 177.559 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -72.87 101.72 1.35 Allowed 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 121.711 1.608 . . . . 0.0 112.281 -176.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -111.26 140.51 45.76 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.64 175.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 47.3 p -81.92 165.52 20.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.956 0.408 . . . . 0.0 110.474 177.249 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.4 -33.02 74.64 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.784 177.674 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -63.49 -42.15 98.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.076 178.132 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.503 ' O ' HG13 ' A' ' 82' ' ' ILE . 2.7 mm-40 -58.14 -48.19 81.01 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.829 177.002 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 42.3 mm -62.69 -42.11 94.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.468 -178.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -61.96 -43.69 98.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.974 0.416 . . . . 0.0 110.572 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 27.2 tpt180 -60.67 -45.89 92.43 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.353 -0.839 . . . . 0.0 111.078 178.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 78' ' ' GLU . 82.8 mt -67.91 -35.6 72.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.102 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 71.5 mt -77.8 -13.4 59.9 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 -179.034 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 20.8 p . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.474 -0.774 . . . . 0.0 109.975 175.675 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? . . . . . 0 N--CA 1.455 -0.18 0 CA-C-O 120.333 0.111 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.453 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 28.2 mtm180 -66.51 -41.11 89.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.502 0.191 . . . . 0.0 110.772 178.148 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.423 ' O ' HG23 ' A' ' 33' ' ' VAL . 70.6 t -63.09 -41.96 94.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 175.491 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.4 m -58.6 -46.96 85.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.262 176.561 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -62.37 -38.41 89.46 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.142 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.441 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -70.43 -45.34 66.05 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.168 -177.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.581 HG13 HG12 ' A' ' 70' ' ' VAL . 71.3 t -61.5 -44.68 98.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.877 0.37 . . . . 0.0 110.454 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -69.43 -33.66 73.29 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.924 -179.567 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -71.4 -43.07 67.51 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.953 0.406 . . . . 0.0 110.388 179.068 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.682 ' HB2' HG11 ' A' ' 70' ' ' VAL . 90.4 mt -64.27 -29.22 70.32 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.27 178.87 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.4 mt -85.35 6.5 26.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.168 -0.469 . . . . 0.0 112.084 -178.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -82.13 139.0 34.62 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.214 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.503 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 25.1 t -58.21 -37.4 74.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.628 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -68.18 -37.03 80.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.16 0.505 . . . . 0.0 110.438 -179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.572 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.0 t -79.33 -34.21 16.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.34 -176.535 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.503 ' HG2' ' O ' ' A' ' 39' ' ' SER . 39.6 ptt180 -68.26 -22.21 64.77 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.79 0.329 . . . . 0.0 110.543 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.2 ttp180 -84.75 -19.22 33.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.867 -178.668 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.22 161.35 49.44 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.92 178.336 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.415 ' HG2' ' OG ' ' A' ' 48' ' ' SER . 32.6 Cg_endo -63.53 155.99 59.43 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.687 2.258 . . . . 0.0 112.264 177.178 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.425 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.8 OUTLIER -61.69 -38.28 87.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.291 -177.509 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.8 m -58.76 -41.13 85.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.01 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.415 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 62.2 m -61.77 -45.99 91.51 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.801 178.393 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.572 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 80.1 mttt -56.91 -49.18 76.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.241 178.741 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.433 HG13 HG21 ' A' ' 63' ' ' ILE . 84.5 t -63.23 -45.28 98.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.143 -177.391 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 39.8 m170 -64.83 -37.24 86.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.964 -178.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -66.71 -45.99 76.98 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.691 0.281 . . . . 0.0 110.349 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 88.1 mt -62.23 -37.4 85.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.69 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.2 tppt? -59.79 -42.55 93.62 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.152 174.516 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.6 m -67.51 -15.32 63.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.973 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 27.6 mmtp -86.77 -4.6 59.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.901 177.197 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.15 7.68 55.93 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.858 -0.686 . . . . 0.0 112.753 178.328 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.453 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 5.1 mp -73.13 150.4 42.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.368 0.604 . . . . 0.0 111.602 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.6 m -90.88 161.28 15.29 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.362 -0.835 . . . . 0.0 108.78 173.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.27 -38.71 77.51 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.989 0.424 . . . . 0.0 110.498 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.474 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 1.8 mp0 -59.64 -43.16 93.95 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.716 177.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.11 -43.66 77.9 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.77 -178.712 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.433 HG21 HG13 ' A' ' 50' ' ' VAL . 74.7 mt -60.78 -44.34 97.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.079 176.746 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 52.9 t -59.37 -43.94 92.8 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.721 178.192 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.715 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 30.3 tt0 -67.53 -48.99 65.43 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.879 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.477 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.65 -45.24 81.74 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 120.54 0.21 . . . . 0.0 111.047 -178.379 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.569 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.7 m-85 -57.04 -44.95 83.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.927 0.394 . . . . 0.0 111.055 177.448 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.8 m -65.14 -33.14 75.32 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.251 0.548 . . . . 0.0 110.485 -177.311 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.715 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 20.7 mtpp -71.65 -32.34 67.82 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.797 -179.21 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.682 HG11 ' HB2' ' A' ' 36' ' ' LEU . 15.2 m -81.9 -4.41 7.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 121.049 -0.261 . . . . 0.0 111.314 -177.597 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 102.04 16.66 22.84 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.407 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.421 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 5.6 tp-100 -126.79 90.93 48.43 Favored Pre-proline 0 C--N 1.323 -0.587 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -74.02 99.43 1.17 Allowed 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 121.974 1.783 . . . . 0.0 112.268 -176.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.425 ' HE3' HG21 ' A' ' 46' ' ' THR . 72.7 mmtt -106.46 138.08 43.29 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.557 175.817 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.425 ' O ' HG12 ' A' ' 79' ' ' ILE . 63.7 p -77.32 156.31 31.41 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.26 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 37.8 tp -62.94 -32.69 74.06 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.386 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -60.79 -46.08 91.88 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.626 175.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -60.44 -43.76 96.48 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.383 178.357 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 75' ' ' THR . 45.7 mm -60.35 -43.25 93.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.533 0.206 . . . . 0.0 110.684 -178.208 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -63.98 -41.35 97.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.295 0.569 . . . . 0.0 110.649 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -59.8 -42.45 93.44 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.825 177.64 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 79.8 mt -73.91 -32.69 34.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.288 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 64.3 mt -80.92 -1.97 45.7 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.248 1.011 0 CA-C-O 119.144 -0.455 . . . . 0.0 110.485 175.857 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.0 pttt . . . . . 0 N--CA 1.45 -0.447 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.531 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 31.9 mtm180 -65.9 -44.22 85.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.746 -0.206 . . . . 0.0 110.65 177.651 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.566 ' O ' HG23 ' A' ' 33' ' ' VAL . 94.5 t -60.75 -44.56 97.6 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.159 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 174.659 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 29.6 m -58.71 -44.17 90.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.749 178.085 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -62.77 -37.07 85.17 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.169 0.509 . . . . 0.0 110.763 177.816 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.03 -44.41 63.44 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.914 -178.741 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.566 HG23 ' O ' ' A' ' 29' ' ' VAL . 92.9 t -61.38 -42.9 95.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.458 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.5 -36.79 76.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.662 0.268 . . . . 0.0 110.938 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -71.48 -42.95 67.43 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.945 0.402 . . . . 0.0 110.636 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.679 ' HB2' HG11 ' A' ' 70' ' ' VAL . 80.6 mt -66.97 -30.75 70.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.196 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.566 ' HG ' HG12 ' A' ' 70' ' ' VAL . 12.6 mt -85.38 7.49 22.3 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.628 -178.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -81.16 137.98 35.89 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.058 175.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.444 ' HA ' ' HG2' ' A' ' 42' ' ' ARG . 15.8 m -61.53 -36.45 80.61 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.773 -176.366 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.47 ' H ' ' HD2' ' A' ' 40' ' ' ARG . 3.6 mpt_? -70.33 -39.38 74.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.225 0.535 . . . . 0.0 109.66 -179.516 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.48 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 91.3 t -76.36 -36.78 30.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.603 -177.589 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.444 ' HG2' ' HA ' ' A' ' 39' ' ' SER . 40.2 ptt180 -65.91 -20.18 66.13 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 121.937 -0.477 . . . . 0.0 109.792 176.685 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 28.2 tpt180 -83.07 -19.03 37.61 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.545 179.45 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 p -82.4 161.18 60.31 Favored Pre-proline 0 C--N 1.33 -0.241 0 O-C-N 122.144 -0.347 . . . . 0.0 111.081 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -59.94 149.74 82.23 Favored 'Trans proline' 0 C--O 1.237 0.428 0 C-N-CA 122.641 2.227 . . . . 0.0 112.032 176.114 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.88 -36.39 76.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.247 -177.76 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.7 p -58.56 -42.61 88.34 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.121 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 52.0 m -62.06 -45.86 91.67 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.065 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.504 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 82.3 mttt -57.09 -49.91 74.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.326 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 81.3 t -63.58 -44.88 98.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.012 -177.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -64.83 -38.69 91.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.306 -177.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -64.63 -47.89 76.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.667 0.27 . . . . 0.0 110.469 178.454 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 86.1 mt -62.23 -41.05 98.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.203 -178.463 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.415 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 38.0 tptt -61.57 -42.27 98.6 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 120.923 0.392 . . . . 0.0 110.266 177.46 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.9 m -67.45 -17.33 64.66 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.106 179.262 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.18 -3.59 52.7 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.882 0.372 . . . . 0.0 110.982 177.018 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.24 8.34 47.41 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.922 176.326 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.531 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.4 mp -75.11 157.15 35.18 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.631 0.729 . . . . 0.0 111.821 -179.118 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.8 m -95.05 160.69 14.45 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.947 172.691 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.67 -37.69 76.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.897 0.379 . . . . 0.0 111.386 -177.107 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -70.66 -29.49 65.85 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.438 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -71.37 -44.36 65.16 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.073 0.463 . . . . 0.0 110.233 177.085 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 60.0 mt -62.49 -42.1 94.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.048 176.483 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 48.3 t -56.77 -46.29 81.55 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.267 -0.878 . . . . 0.0 110.963 178.197 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -66.59 -47.53 72.42 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.666 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.24 -42.07 80.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.595 -176.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.416 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.1 m-85 -61.45 -44.96 96.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.088 0.47 . . . . 0.0 110.78 176.391 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.1 m -64.71 -33.63 76.42 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.202 0.525 . . . . 0.0 110.297 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.7 mmmt -62.98 -36.56 83.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.38 178.691 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.679 HG11 ' HB2' ' A' ' 36' ' ' LEU . 19.7 m -89.61 3.69 6.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -174.528 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.06 18.42 29.29 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.275 -0.964 . . . . 0.0 112.9 177.554 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.404 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 5.7 tp-100 -126.77 90.83 48.69 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.202 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -71.6 100.34 1.03 Allowed 'Trans proline' 0 N--CA 1.461 -0.4 0 C-N-CA 121.955 1.77 . . . . 0.0 112.816 -175.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -108.33 146.38 33.05 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.989 176.682 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 39.1 p -89.37 165.84 14.11 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.593 177.65 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 61.0 tp -63.32 -35.19 79.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.277 0.56 . . . . 0.0 109.599 174.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.95 -40.5 96.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.594 178.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.477 ' O ' HG13 ' A' ' 82' ' ' ILE . 12.5 mm-40 -56.92 -49.27 76.12 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.592 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.5 mm -63.02 -45.44 98.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.742 -176.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -57.63 -42.53 83.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.145 0.497 . . . . 0.0 111.177 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -66.4 -48.02 71.43 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.771 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 78' ' ' GLU . 86.5 mt -62.25 -36.19 73.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.289 -178.102 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.7 mt -78.09 -25.79 47.76 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.078 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 69.9 m . . . . . 0 C--O 1.249 1.054 0 O-C-N 123.84 0.712 . . . . 0.0 112.288 179.47 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? . . . . . 0 C--O 1.226 -0.174 0 N-CA-C 110.843 -0.058 . . . . 0.0 110.843 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.439 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 20.6 mtm180 -58.88 -48.97 79.5 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 120.893 0.378 . . . . 0.0 110.6 177.485 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.561 ' O ' HG23 ' A' ' 33' ' ' VAL . 99.2 t -63.12 -45.15 99.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.192 177.876 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.1 t -58.58 -45.23 89.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.728 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -62.12 -38.72 89.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.072 0.463 . . . . 0.0 110.768 179.321 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.23 -43.89 63.71 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.066 179.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 29' ' ' VAL . 69.2 t -60.95 -43.18 95.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.553 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -69.65 -35.45 75.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.724 0.297 . . . . 0.0 111.062 179.602 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -72.6 -43.13 63.74 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 120.991 0.424 . . . . 0.0 110.908 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.632 ' HB2' HG11 ' A' ' 70' ' ' VAL . 91.5 mt -65.71 -30.41 71.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.847 179.319 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.6 mt -85.82 7.15 25.0 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.526 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -78.76 138.87 38.43 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.835 0.35 . . . . 0.0 110.627 -178.444 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.605 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 14.9 t -57.87 -35.21 70.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.329 -178.499 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -69.87 -38.84 76.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.148 0.499 . . . . 0.0 110.984 178.338 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.6 t -79.39 -27.91 13.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.739 -174.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.605 ' HG2' ' O ' ' A' ' 39' ' ' SER . 39.0 ptt180 -64.13 -21.84 66.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.953 0.406 . . . . 0.0 110.735 178.583 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -88.27 -17.54 30.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.032 -179.519 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.8 p -86.01 157.04 57.51 Favored Pre-proline 0 C--N 1.326 -0.43 0 C-N-CA 121.055 -0.258 . . . . 0.0 111.089 179.378 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.423 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 35.7 Cg_endo -64.88 159.81 44.17 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.718 2.278 . . . . 0.0 112.149 177.182 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.576 HG21 ' HE3' ' A' ' 74' ' ' LYS . 1.3 m -59.8 -41.53 91.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.024 -178.222 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.459 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 10.1 m -58.65 -40.56 83.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.34 -176.142 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.6 m -63.57 -42.38 98.33 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 120.719 0.295 . . . . 0.0 110.999 177.69 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 45' ' ' PRO . 80.8 mttt -59.79 -48.32 82.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.124 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 58.5 t -65.84 -43.22 93.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.887 -177.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 37.1 m170 -62.84 -39.61 94.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.598 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -64.24 -51.08 65.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.554 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 94.9 mt -60.55 -38.69 85.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.969 -178.02 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.37 -44.18 97.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.165 0.507 . . . . 0.0 110.152 176.778 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 18.5 m -64.77 -19.34 65.76 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.445 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -85.22 -1.37 56.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.275 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 96.01 12.71 51.82 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.619 177.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.439 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.6 mp -81.57 152.63 27.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.051 0.453 . . . . 0.0 111.033 177.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.512 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 17.8 m -95.6 163.97 12.98 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.422 176.456 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.18 -37.57 75.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.889 0.376 . . . . 0.0 111.349 -177.719 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -65.01 -40.76 95.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.485 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.512 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 4.6 mm-40 -64.28 -45.1 89.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.309 0.576 . . . . 0.0 109.514 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 76.6 mt -63.03 -45.48 98.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.9 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 48.2 t -56.81 -45.29 82.35 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.298 -179.182 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -68.13 -47.36 68.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.806 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.13 -41.78 79.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.486 -179.061 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.418 ' O ' HG22 ' A' ' 70' ' ' VAL . 2.8 m-85 -59.32 -47.97 83.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.946 177.482 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.0 m -63.98 -32.63 74.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.23 0.538 . . . . 0.0 110.322 -179.621 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mmmt -65.51 -33.99 77.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.065 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.632 HG11 ' HB2' ' A' ' 36' ' ' LEU . 26.0 m -89.14 5.78 4.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.742 0.306 . . . . 0.0 111.701 -177.256 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.78 22.37 33.73 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.532 -0.842 . . . . 0.0 112.326 178.105 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -127.36 91.03 47.22 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 175.624 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -70.1 104.45 1.37 Allowed 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 121.788 1.659 . . . . 0.0 112.168 -177.043 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.576 ' HE3' HG21 ' A' ' 46' ' ' THR . 72.5 mmtt -115.12 137.52 51.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.318 176.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 73.9 p -81.76 162.3 22.97 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 178.691 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 55.1 tp -62.39 -33.14 74.18 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.417 0.627 . . . . 0.0 109.41 177.261 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -61.9 -45.2 94.75 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.553 177.445 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -59.41 -47.0 87.14 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.038 179.375 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 43.5 mm -59.53 -46.21 93.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.563 -177.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -64.48 -38.43 90.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.027 0.441 . . . . 0.0 111.192 178.288 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -66.03 -41.41 90.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.822 178.754 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.459 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 81.1 mt -67.1 -32.22 56.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.23 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 98.7 mt -78.13 -20.82 51.35 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.051 178.493 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 12.4 m . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.593 -177.567 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 33.4 pttt . . . . . 0 N--CA 1.481 1.091 0 N-CA-C 110.689 -0.115 . . . . 0.0 110.689 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.08 117.37 5.12 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.27 1.98 . . . . 0.0 110.714 171.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -84.34 93.74 8.31 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.347 0.594 . . . . 0.0 109.805 -175.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 44.6 t -94.38 -35.55 6.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.713 -177.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -128.9 -170.45 2.27 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.813 178.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 39.5 m80 -100.3 164.04 12.12 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.0 m -59.98 98.53 0.06 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.904 0.383 . . . . 0.0 110.948 -178.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -71.12 -24.48 62.29 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.091 -174.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 28.5 m -65.68 -33.69 76.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.969 0.414 . . . . 0.0 110.032 176.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.54 ' O ' ' HG2' ' A' ' 27' ' ' LYS . 38.7 tt0 -71.5 -41.46 69.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.957 179.318 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -66.27 -46.9 75.43 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.313 175.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -57.34 -40.98 79.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.539 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 17.2 pttp -72.19 -32.21 66.61 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 121.043 -0.263 . . . . 0.0 111.013 -178.75 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.505 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 82.8 mtm-85 -67.8 -44.06 78.23 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 176.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.537 ' O ' HG23 ' A' ' 33' ' ' VAL . 87.6 t -61.41 -38.5 80.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.745 175.404 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.2 t -58.32 -45.66 87.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.413 177.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -61.87 -36.6 81.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.22 178.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.39 -45.25 55.88 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.235 -179.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 29' ' ' VAL . 94.7 t -62.4 -40.0 86.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.764 -178.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -68.92 -38.75 79.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.796 0.331 . . . . 0.0 110.753 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -71.74 -42.6 67.06 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.745 -178.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.676 ' HB2' HG11 ' A' ' 70' ' ' VAL . 89.8 mt -67.28 -30.92 70.93 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.155 179.448 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.48 ' HG ' HG12 ' A' ' 70' ' ' VAL . 9.6 mt -85.32 6.04 28.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.565 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.634 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 12.2 t70 -73.94 128.91 36.77 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -53.52 -44.0 68.78 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -175.326 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 86.1 mtm180 -69.11 -33.59 73.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.292 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.535 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 98.5 t -73.59 -28.68 25.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.159 0.504 . . . . 0.0 110.419 178.022 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.634 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 90.9 mtt180 -62.43 -22.26 66.05 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.042 0.449 . . . . 0.0 110.322 173.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 34.9 ttm180 -93.46 -17.07 23.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.332 -177.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.6 p -80.31 158.32 71.91 Favored Pre-proline 0 C--N 1.33 -0.277 0 O-C-N 122.269 -0.269 . . . . 0.0 110.654 174.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.411 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 36.9 Cg_endo -67.05 156.3 66.95 Favored 'Trans proline' 0 C--O 1.234 0.324 0 C-N-CA 122.595 2.196 . . . . 0.0 112.234 178.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.508 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -59.66 -37.91 80.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.924 -177.996 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.6 p -58.42 -42.77 87.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.466 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.9 m -63.97 -42.68 97.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.118 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.535 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 78.4 mttt -60.88 -49.45 77.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.284 178.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 46' ' ' THR . 63.7 t -65.18 -44.62 95.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.187 -174.67 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 15.7 m170 -63.31 -37.83 88.79 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.217 -177.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -70.57 -45.57 65.15 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.897 -178.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 91.8 mt -61.99 -40.19 94.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.049 -178.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.471 ' HD2' ' C ' ' A' ' 54' ' ' LYS . 0.9 OUTLIER -59.77 -43.7 94.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.323 0.583 . . . . 0.0 109.888 177.521 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.4 m -68.7 -14.36 62.97 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.396 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 35.5 mtpt -87.58 3.67 46.67 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.949 177.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.72 2.4 52.76 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.994 174.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.505 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.8 mp -78.24 154.66 30.83 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.372 0.606 . . . . 0.0 111.663 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.401 ' O ' HG13 ' A' ' 63' ' ' ILE . 16.2 m -95.9 161.22 14.09 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.309 173.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.9 -38.66 76.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.855 0.359 . . . . 0.0 111.284 -177.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.02 -37.42 87.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.988 178.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -71.53 -39.26 70.85 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.386 -179.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 59' ' ' SER . 80.6 mt -63.16 -43.96 99.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.189 176.246 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 40.7 t -56.71 -42.19 78.73 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.913 177.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -68.18 -48.54 64.99 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.917 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.21 -41.91 80.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.403 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.427 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.8 m-85 -58.81 -46.58 87.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.95 0.405 . . . . 0.0 110.83 176.353 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 20.8 m -65.21 -33.05 75.08 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.108 0.48 . . . . 0.0 110.081 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -63.28 -35.77 81.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.642 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.676 HG11 ' HB2' ' A' ' 36' ' ' LEU . 23.0 m -88.46 5.23 4.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-O 120.992 0.425 . . . . 0.0 111.643 -177.279 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 93.53 18.89 36.8 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.662 177.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -121.58 91.01 48.37 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.55 99.46 1.22 Allowed 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 121.982 1.788 . . . . 0.0 112.368 -177.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -109.85 144.29 38.51 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.645 176.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.435 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 24.3 p -81.79 157.81 24.35 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 175.354 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 53.6 tp -60.78 -32.66 71.97 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.107 0.479 . . . . 0.0 110.568 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -59.78 -42.19 92.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.745 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.435 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 58.1 mm-40 -59.47 -48.66 80.79 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.291 178.018 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 46.1 mm -60.36 -48.41 88.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.037 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -63.48 -38.14 90.0 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.861 0.362 . . . . 0.0 110.648 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.6 ttm180 -61.95 -48.71 79.17 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.924 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 78' ' ' GLU . 69.2 mt -64.34 -33.09 60.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.072 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.409 HD21 HG12 ' A' ' 50' ' ' VAL . 79.2 mt -79.2 -17.25 55.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.766 -179.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.6 p . . . . . 0 C--O 1.252 1.206 0 CA-C-O 118.308 -0.853 . . . . 0.0 110.621 179.598 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.7 pttp . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -63.67 134.87 46.09 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.127 1.884 . . . . 0.0 111.739 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -105.89 95.73 6.0 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.259 0.552 . . . . 0.0 110.819 -178.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 60.9 t -117.88 98.66 6.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.452 -0.794 . . . . 0.0 108.961 177.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -100.29 93.79 5.86 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.84 -176.158 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 47.3 t-80 -94.86 94.08 7.84 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.2 m -66.56 109.2 2.7 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.254 -175.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 5.3 p-80 -66.01 -28.81 69.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.759 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.7 m -63.23 -32.09 73.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.56 178.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -68.73 -44.11 74.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.833 179.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.428 ' O ' HG23 ' A' ' 29' ' ' VAL . 22.9 ttm180 -68.09 -48.01 66.67 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 175.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -56.62 -44.58 81.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.108 -176.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -67.69 -39.29 84.44 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.959 -0.297 . . . . 0.0 110.598 -177.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.465 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 83.3 mtm180 -69.93 -40.4 75.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.66 -179.41 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.494 ' O ' HG23 ' A' ' 33' ' ' VAL . 84.6 t -62.49 -42.24 95.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 175.106 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.6 t -61.95 -42.36 99.03 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.49 178.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -61.37 -36.88 81.46 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 121.268 0.556 . . . . 0.0 110.472 177.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.433 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -73.34 -44.74 58.26 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.05 179.443 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 29' ' ' VAL . 78.2 t -60.81 -43.21 94.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.403 -179.267 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -68.23 -34.61 76.55 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.686 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -72.78 -43.59 62.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.657 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.762 ' HB2' HG11 ' A' ' 70' ' ' VAL . 94.8 mt -68.47 -32.16 71.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.111 0.481 . . . . 0.0 111.327 -178.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.9 mt -86.4 7.05 27.28 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.433 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.605 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 9.5 t70 -81.59 134.8 35.54 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.4 p -56.64 -32.9 65.79 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.696 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -68.13 -43.07 79.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.133 0.492 . . . . 0.0 110.571 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.418 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.5 t -78.04 -24.14 13.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.072 -175.494 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.605 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 83.9 mtt180 -60.97 -21.8 63.86 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.906 0.384 . . . . 0.0 110.358 173.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -85.69 -18.79 32.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.261 -177.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 p -88.32 155.81 51.48 Favored Pre-proline 0 C--N 1.328 -0.369 0 O-C-N 122.439 -0.163 . . . . 0.0 111.155 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.42 156.32 65.86 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.757 2.304 . . . . 0.0 112.04 176.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.443 HG21 ' HE3' ' A' ' 74' ' ' LYS . 2.2 m -60.06 -40.17 88.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.476 -176.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.6 m -58.55 -38.39 77.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.015 -177.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.1 m -65.55 -45.17 84.41 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.629 177.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.567 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 82.1 mttt -57.34 -48.59 78.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.058 178.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.509 HG12 HD21 ' A' ' 83' ' ' LEU . 57.9 t -63.84 -46.02 95.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.191 -177.456 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 17.0 m170 -64.53 -39.5 93.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.81 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -66.2 -42.72 88.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.097 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 67.3 mt -63.69 -34.76 78.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.804 178.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.532 ' HD3' HD22 ' A' ' 83' ' ' LEU . 33.8 ttpt -61.09 -44.36 97.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.805 0.336 . . . . 0.0 110.222 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.4 p -72.41 -12.98 61.34 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.515 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -81.98 1.35 35.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.859 0.361 . . . . 0.0 110.936 176.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 93.98 14.43 52.03 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.364 178.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.465 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 5.9 mp -91.49 147.99 22.62 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.013 0.435 . . . . 0.0 111.589 179.269 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.423 ' O ' HG13 ' A' ' 63' ' ' ILE . 1.9 m -92.72 173.25 7.86 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.006 173.356 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.87 -36.01 76.0 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.712 0.292 . . . . 0.0 111.087 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.7 mp0 -66.43 -45.23 80.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.919 -179.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -62.88 -43.32 99.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.523 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.426 HG23 HD12 ' A' ' 53' ' ' LEU . 78.2 mt -63.08 -45.12 99.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.649 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.5 t -57.78 -45.2 86.33 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.213 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.692 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 33.4 tt0 -67.35 -47.64 69.85 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.602 -178.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.545 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.89 -45.38 82.59 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.137 -178.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.574 ' O ' HG22 ' A' ' 70' ' ' VAL . 2.7 m-85 -57.98 -42.23 84.64 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.193 178.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.1 m -67.16 -33.29 75.1 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.177 0.513 . . . . 0.0 110.416 -177.215 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.692 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 20.1 mtpp -72.39 -29.79 64.07 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.986 -179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.762 HG11 ' HB2' ' A' ' 36' ' ' LEU . 10.8 m -83.75 0.27 4.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.854 0.359 . . . . 0.0 111.534 -178.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 96.13 18.33 31.84 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.42 178.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -127.46 91.15 46.7 Favored Pre-proline 0 C--N 1.323 -0.587 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -73.72 93.78 0.86 Allowed 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 121.992 1.795 . . . . 0.0 112.817 -175.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.443 ' HE3' HG21 ' A' ' 46' ' ' THR . 74.2 mmtt -103.65 137.46 41.67 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.482 175.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.452 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 70.0 p -77.47 162.92 26.8 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.263 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 44.3 tp -62.53 -32.63 73.6 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.119 -0.696 . . . . 0.0 109.119 175.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -60.35 -46.32 90.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.818 176.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.452 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 36.7 mm-40 -59.57 -45.88 90.55 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.09 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.419 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 39.4 mm -60.21 -46.78 94.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.524 -177.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -64.39 -39.52 94.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.932 0.396 . . . . 0.0 110.659 177.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.9 tpp180 -60.18 -46.55 89.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.393 177.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.5 mt -67.93 -31.99 54.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.202 -178.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.532 HD22 ' HD3' ' A' ' 54' ' ' LYS . 91.8 mt -82.64 -4.03 57.13 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.741 0.305 . . . . 0.0 111.358 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 45.5 m . . . . . 0 C--O 1.252 1.208 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.614 177.513 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt . . . . . 0 N--CA 1.482 1.125 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -68.84 149.92 73.13 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.372 2.048 . . . . 0.0 111.382 176.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -93.03 22.34 5.06 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.8 0.333 . . . . 0.0 111.409 -176.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 60.1 t -64.67 -43.76 96.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 176.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.427 ' OE1' ' HB2' ' A' ' 25' ' ' ARG . 44.7 mt-10 -122.6 103.56 8.77 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.868 174.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 22.2 p80 -118.52 4.66 11.72 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.927 0.394 . . . . 0.0 110.172 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.9 m -131.57 115.54 16.24 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.855 177.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 42.2 m-70 -64.92 -35.55 81.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.747 -176.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.4 t -63.66 -31.82 73.11 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.919 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.449 ' HA ' ' HE2' ' A' ' 27' ' ' LYS . 41.6 mt-10 -68.55 -40.39 80.67 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 121.061 -0.256 . . . . 0.0 110.647 -179.433 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.474 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 13.8 ttm180 -66.4 -46.63 75.96 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 174.352 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -55.96 -44.8 78.81 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.558 -175.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.449 ' HE2' ' HA ' ' A' ' 24' ' ' GLU . 60.4 pttt -68.92 -42.64 76.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.189 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.1 mtm-85 -70.47 -41.13 73.14 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 122.29 -0.256 . . . . 0.0 111.572 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.474 ' O ' HG23 ' A' ' 33' ' ' VAL . 75.2 t -66.01 -39.37 84.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 121.066 -0.253 . . . . 0.0 110.537 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.9 m -58.6 -40.59 83.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.71 0.29 . . . . 0.0 110.49 176.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.449 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 29.8 m-80 -66.55 -36.29 82.31 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.957 177.185 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.48 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -72.38 -45.22 60.76 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.441 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.58 HG13 HG12 ' A' ' 70' ' ' VAL . 78.2 t -61.36 -41.46 89.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.623 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 11.2 pt-20 -68.4 -33.64 74.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 0.0 110.658 178.601 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -71.88 -43.57 65.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.627 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.836 ' HB2' HG11 ' A' ' 70' ' ' VAL . 96.5 mt -67.75 -30.3 69.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.248 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.8 mt -85.82 4.24 38.01 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.018 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.549 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 18.4 t70 -75.04 132.81 41.58 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 177.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.5 m -53.66 -39.98 65.5 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 -174.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -69.17 -47.47 64.85 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.036 0.445 . . . . 0.0 110.327 178.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.3 t -66.65 -25.64 35.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.975 -177.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.549 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 83.0 mtp180 -65.52 -22.13 66.69 Favored 'General case' 0 C--N 1.319 -0.737 0 O-C-N 122.151 -0.343 . . . . 0.0 111.371 175.601 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 74.9 mtm180 -101.67 6.99 42.17 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -175.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.601 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -96.14 169.92 8.32 Favored Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 175.116 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.601 ' HD2' HG22 ' A' ' 44' ' ' THR . 57.2 Cg_endo -71.05 157.53 57.56 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.335 2.023 . . . . 0.0 111.906 175.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.478 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.3 OUTLIER -68.5 -39.83 81.12 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.524 -176.82 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.8 m -58.86 -35.8 73.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.521 -175.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.462 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 70.1 m -64.06 -44.82 91.29 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.221 0.534 . . . . 0.0 110.915 179.357 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.481 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 24.5 mttm -63.56 -45.47 90.37 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.502 -178.047 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 77.8 t -62.51 -44.62 99.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.57 -177.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 31.1 m170 -64.84 -38.24 90.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.401 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.491 ' O ' ' HG3' ' A' ' 56' ' ' LYS . 55.8 t80 -68.82 -43.37 75.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.725 -179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 76.8 mt -66.26 -38.7 88.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.756 0.312 . . . . 0.0 110.793 179.376 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -60.37 -40.6 91.42 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.242 0.544 . . . . 0.0 109.763 173.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.0 t -68.64 -20.03 64.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.244 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 52' ' ' PHE . 28.9 mtpp -81.5 -7.83 59.64 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.904 177.047 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.95 10.55 39.65 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.832 178.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.8 mp -82.31 145.13 30.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.276 0.56 . . . . 0.0 111.77 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.443 ' O ' HG13 ' A' ' 63' ' ' ILE . 8.6 m -85.42 164.82 17.66 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.123 175.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.33 -35.44 71.9 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.137 0.494 . . . . 0.0 110.404 178.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.403 ' HB3' HH22 ' A' ' 25' ' ' ARG . 62.4 mm-40 -62.79 -48.94 76.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.703 177.506 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.474 ' OE1' ' HA ' ' A' ' 25' ' ' ARG . 38.6 mt-10 -64.9 -44.49 89.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.242 -177.045 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 59' ' ' SER . 73.2 mt -59.77 -41.79 86.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.258 178.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.1 t -59.31 -44.52 92.55 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.609 178.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -68.3 -45.92 71.72 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.192 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.565 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.56 -45.32 81.31 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.515 -178.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.573 ' O ' HG22 ' A' ' 70' ' ' VAL . 7.6 m-85 -59.95 -45.05 93.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.107 0.479 . . . . 0.0 110.934 178.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.0 m -64.82 -33.13 75.26 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.622 -178.107 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.556 ' HE3' HG21 ' A' ' 33' ' ' VAL . 20.1 mtmt -71.77 -32.14 67.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.652 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.836 HG11 ' HB2' ' A' ' 36' ' ' LEU . 13.4 m -81.64 -3.83 7.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.714 0.292 . . . . 0.0 111.286 -177.554 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 100.01 18.21 22.97 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.298 179.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -126.6 90.94 48.59 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -73.63 97.18 0.95 Allowed 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 121.993 1.795 . . . . 0.0 112.748 -174.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.478 ' HE3' HG21 ' A' ' 46' ' ' THR . 74.3 mmtt -107.38 137.76 44.83 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.914 174.178 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.502 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 45.4 p -82.22 169.21 16.84 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.477 178.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.2 tp -62.9 -33.54 75.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.368 0.604 . . . . 0.0 109.811 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -60.27 -45.44 93.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.798 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.502 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 12.2 mm-40 -60.78 -47.15 87.63 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.052 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 42.6 mm -60.17 -46.15 94.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.805 -177.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 60.3 mttm -64.02 -40.06 95.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.363 . . . . 0.0 111.069 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -64.55 -43.61 93.4 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.74 178.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 72.7 mt -66.92 -31.73 54.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.618 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.9 mt -81.09 -6.85 59.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.482 177.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 14.4 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.433 -0.794 . . . . 0.0 109.746 177.175 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.6 mttm . . . . . 0 N--CA 1.481 1.093 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -73.4 162.43 40.21 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.64 2.227 . . . . 0.0 111.84 177.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.52 ' CD ' ' H ' ' A' ' 17' ' ' GLU . 0.3 OUTLIER -91.82 20.29 5.77 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.126 0.489 . . . . 0.0 111.011 -176.373 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 25.6 t -81.41 -19.26 11.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.814 -178.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -74.44 -37.51 63.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.951 0.405 . . . . 0.0 110.615 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -122.18 87.93 2.84 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 177.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.4 p -72.14 171.23 12.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.528 -175.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 72.8 m-70 -65.36 -42.91 92.27 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.868 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 32.6 t -64.37 -38.04 89.62 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.751 0.31 . . . . 0.0 110.249 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.536 ' O ' ' HG2' ' A' ' 27' ' ' LYS . 27.6 tt0 -65.55 -47.35 76.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.85 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.44 ' O ' HG23 ' A' ' 29' ' ' VAL . 20.7 ptp180 -69.53 -39.04 77.72 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.433 178.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -60.39 -44.46 95.65 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.405 -179.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 21.7 ptmt -66.43 -37.13 84.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.727 -177.723 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.572 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 82.7 mtm-85 -68.36 -44.23 75.68 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.862 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.57 ' O ' HG23 ' A' ' 33' ' ' VAL . 94.2 t -60.9 -41.94 90.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 110.027 -0.361 . . . . 0.0 110.027 177.173 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.0 t -60.64 -45.55 93.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.842 0.353 . . . . 0.0 110.404 178.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -62.86 -35.31 79.57 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.996 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.39 -44.73 64.4 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.152 179.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.578 HG13 HG12 ' A' ' 70' ' ' VAL . 87.4 t -60.98 -42.69 93.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.56 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -68.65 -35.18 76.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.839 179.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -71.76 -43.25 66.09 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-O 120.925 0.393 . . . . 0.0 110.791 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.762 ' HB2' HG11 ' A' ' 70' ' ' VAL . 87.1 mt -65.24 -30.68 71.58 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.329 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.449 ' HA ' HD23 ' A' ' 37' ' ' LEU . 13.0 mt -85.72 7.47 23.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.979 -178.339 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.48 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 13.5 t70 -78.99 138.06 37.87 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 176.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.0 m -57.09 -39.63 75.39 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -176.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -68.22 -37.09 80.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.059 0.457 . . . . 0.0 110.412 -179.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.552 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 70.7 t -75.13 -34.01 30.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.758 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.48 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 84.0 mtp180 -63.84 -21.14 66.3 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.03 0.443 . . . . 0.0 110.303 174.346 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -88.52 -17.49 30.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.026 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.5 p -85.52 159.7 55.18 Favored Pre-proline 0 C--N 1.329 -0.309 0 O-C-N 122.195 -0.316 . . . . 0.0 110.848 177.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.25 158.9 49.81 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.625 2.217 . . . . 0.0 112.021 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.472 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.3 OUTLIER -61.77 -39.6 92.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.541 -176.052 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.43 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 7.6 t -59.38 -43.1 92.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.765 -176.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.3 m -60.33 -42.89 96.57 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.021 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.552 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 79.9 mttt -60.26 -49.1 78.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.001 178.036 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.476 HG12 HD21 ' A' ' 83' ' ' LEU . 59.2 t -65.59 -44.26 93.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.809 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 22.5 m170 -63.9 -37.41 87.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.013 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -66.89 -44.36 81.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.463 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 89.0 mt -66.5 -41.15 89.31 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.887 -178.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.459 ' HD2' ' O ' ' A' ' 58' ' ' LEU . 42.4 tptt -62.84 -37.33 86.4 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.181 0.515 . . . . 0.0 109.926 176.331 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 35.5 t -70.98 -14.24 62.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.821 178.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 37.4 mtpt -91.46 2.1 56.66 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.998 0.428 . . . . 0.0 110.933 176.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.91 6.12 57.18 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.59 -0.814 . . . . 0.0 113.026 176.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.572 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.4 mp -73.19 153.0 40.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.201 0.524 . . . . 0.0 111.283 178.534 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.2 m -92.89 161.86 14.31 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.336 172.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.13 -42.61 86.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.798 0.332 . . . . 0.0 111.147 -177.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -62.16 -38.32 88.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.03 178.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.85 -41.98 86.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.048 0.451 . . . . 0.0 110.384 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.434 HG21 HG13 ' A' ' 50' ' ' VAL . 71.8 mt -63.6 -45.2 98.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.402 176.21 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 45.2 t -56.8 -42.6 79.79 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.016 178.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 57.3 tt0 -66.35 -48.42 70.28 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.659 178.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.521 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.72 -47.91 78.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.093 -178.228 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.617 ' O ' HG22 ' A' ' 70' ' ' VAL . 5.2 m-85 -55.29 -46.83 76.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.022 0.439 . . . . 0.0 111.308 178.254 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.4 m -65.48 -32.63 74.34 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.961 0.41 . . . . 0.0 110.697 -177.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.5 ' HE3' HG21 ' A' ' 33' ' ' VAL . 21.8 mtmt -72.12 -28.88 63.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.769 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.762 HG11 ' HB2' ' A' ' 36' ' ' LEU . 10.6 m -84.18 -1.21 6.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.08 0.467 . . . . 0.0 111.193 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.09 14.05 43.72 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.449 178.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -121.22 90.6 47.57 Favored Pre-proline 0 C--N 1.322 -0.615 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -70.87 105.2 1.62 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.012 1.808 . . . . 0.0 112.167 -175.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -116.35 138.39 51.37 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.791 176.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.1 p -82.03 159.28 23.51 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.34 179.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 55.4 tp -61.7 -32.85 73.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.287 0.565 . . . . 0.0 109.661 177.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -57.01 -46.38 82.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.018 177.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.428 ' O ' HG13 ' A' ' 82' ' ' ILE . 38.3 mt-10 -63.33 -46.94 84.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.527 179.226 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 46.9 mm -59.93 -44.39 94.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.919 -176.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -63.77 -43.09 97.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.058 0.456 . . . . 0.0 110.773 178.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -63.33 -44.72 94.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.979 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.43 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 96.4 mt -63.84 -36.64 77.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.101 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.476 HD21 HG12 ' A' ' 50' ' ' VAL . 75.5 mt -77.53 -25.39 50.19 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.289 -179.438 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 7.1 t . . . . . 0 C--O 1.254 1.3 0 CA-C-O 118.181 -0.914 . . . . 0.0 109.996 -179.107 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 93.3 mttt . . . . . 0 N--CA 1.48 1.031 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -82.99 158.39 15.56 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.572 2.181 . . . . 0.0 111.735 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -99.74 61.69 1.15 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.534 0.683 . . . . 0.0 110.661 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 42.9 t -77.66 -44.93 29.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.613 -178.041 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -71.53 146.52 48.44 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.389 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 -84.76 113.89 21.66 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.377 -177.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.8 p -75.65 110.25 9.9 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.034 176.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 64.2 m170 -62.63 -24.73 67.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.664 -177.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.1 p -61.4 -40.42 94.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.957 177.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.404 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 0.5 OUTLIER -60.87 -43.25 98.69 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.649 178.473 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.458 ' O ' HG23 ' A' ' 29' ' ' VAL . 40.8 ttt180 -67.82 -47.82 67.95 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.061 176.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -60.06 -43.7 95.22 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.742 -175.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -65.02 -38.07 89.7 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.015 -178.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.516 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 88.4 mtm-85 -69.46 -39.55 77.67 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.908 0.385 . . . . 0.0 110.204 177.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.643 ' O ' HG23 ' A' ' 33' ' ' VAL . 71.2 t -62.75 -43.57 98.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.109 174.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 45.3 m -58.0 -45.86 86.16 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.749 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -61.66 -37.64 84.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.092 0.472 . . . . 0.0 110.928 178.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.49 -44.38 62.34 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.46 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.643 HG23 ' O ' ' A' ' 29' ' ' VAL . 67.7 t -61.07 -43.3 95.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.023 0.44 . . . . 0.0 110.355 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -69.22 -35.96 76.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.794 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -72.32 -43.48 64.09 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.834 0.35 . . . . 0.0 110.994 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.619 ' HB2' HG11 ' A' ' 70' ' ' VAL . 75.0 mt -63.61 -31.1 72.16 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.491 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 37' ' ' LEU . 11.7 mt -85.89 6.99 25.83 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -178.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -77.07 139.38 39.99 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.717 -0.393 . . . . 0.0 109.989 177.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.564 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 14.5 m -57.89 -37.04 73.26 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.933 -175.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 33.4 mmt180 -69.57 -38.5 77.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.155 0.502 . . . . 0.0 110.587 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.582 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 58.2 t -74.5 -34.52 35.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.132 -176.511 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' ' 39' ' ' SER . 22.4 ptt180 -67.63 -21.37 65.39 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.877 0.37 . . . . 0.0 110.254 176.48 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -89.28 -7.11 56.1 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.686 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.4 p -96.96 158.4 33.46 Favored Pre-proline 0 C--N 1.326 -0.451 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.012 176.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -62.46 154.88 61.31 Favored 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.703 2.268 . . . . 0.0 111.95 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.446 ' O ' HG23 ' A' ' 50' ' ' VAL . 1.3 m -60.27 -35.63 75.96 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.859 -178.538 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.3 m -58.24 -42.87 87.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.786 -178.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.2 m -63.25 -45.74 90.15 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.873 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.582 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 82.2 mttt -57.46 -49.99 74.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.179 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 46' ' ' THR . 80.9 t -64.23 -43.54 97.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.925 -176.515 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 26.2 m170 -64.56 -37.48 87.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.081 -178.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -69.68 -42.68 73.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.387 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 68.7 mt -64.46 -39.26 93.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.674 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.44 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 29.8 tptt -63.87 -39.93 95.36 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 120.967 0.413 . . . . 0.0 110.102 176.419 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.2 t -69.63 -14.35 62.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.713 178.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -83.86 -1.61 54.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.793 176.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.42 17.92 47.72 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.627 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.516 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.4 mp -83.03 159.0 22.27 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.265 0.555 . . . . 0.0 111.043 177.817 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.1 m -100.59 165.23 11.51 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.438 -0.801 . . . . 0.0 108.897 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.95 -34.51 69.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.906 0.384 . . . . 0.0 110.821 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.97 -49.62 76.95 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.905 177.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -63.67 -43.64 96.12 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.902 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 78.5 mt -60.84 -44.96 98.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.715 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.6 t -60.81 -43.39 98.25 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.7 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.44 ' CD ' HH21 ' A' ' 25' ' ' ARG . 27.5 tt0 -68.85 -48.54 63.22 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.123 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.79 -41.57 82.39 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 120.726 0.298 . . . . 0.0 111.551 -178.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.403 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.1 m-85 -60.93 -45.43 94.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.578 176.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 20.8 m -64.85 -34.33 78.11 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.043 0.449 . . . . 0.0 110.292 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.0 mmmt -63.14 -32.5 73.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.962 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.619 HG11 ' HB2' ' A' ' 36' ' ' LEU . 24.1 m -91.95 8.1 4.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.97 0.414 . . . . 0.0 111.401 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.41 23.7 33.34 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.794 177.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -126.61 91.31 47.71 Favored Pre-proline 0 C--N 1.32 -0.682 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 176.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -72.09 102.92 1.41 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 121.899 1.732 . . . . 0.0 111.744 -178.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -108.93 139.35 43.91 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.657 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 38.1 p -80.49 156.64 26.45 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.183 178.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 38.9 tp -63.25 -32.69 74.16 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.126 0.488 . . . . 0.0 109.943 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -60.36 -45.17 94.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.723 177.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -59.04 -47.58 84.72 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.511 177.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.0 mm -59.8 -45.19 95.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.433 -178.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.2 -44.99 93.79 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.868 0.366 . . . . 0.0 110.874 177.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.3 tpp180 -61.65 -47.22 86.38 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.943 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 86.3 mt -64.6 -34.45 69.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.765 -179.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 80.8 mt -81.61 -4.3 55.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.794 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 38.4 m . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.836 -0.602 . . . . 0.0 110.282 176.004 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 120.761 0.315 . . . . 0.0 110.339 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.73 145.88 20.63 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.548 2.165 . . . . 0.0 111.614 176.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -90.6 91.28 8.35 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.103 0.478 . . . . 0.0 110.302 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 45.9 t -116.78 -59.25 3.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.467 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -69.91 148.4 49.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.392 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 23.8 m-70 63.07 166.55 0.13 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.872 -174.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.4 m 62.7 -75.92 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 122.744 0.417 . . . . 0.0 111.159 -178.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 68.0 m80 -66.15 -45.39 81.14 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.4 t -67.67 -37.89 83.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.377 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -68.1 -40.28 82.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.682 -178.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 41.6 ttt180 -68.11 -47.85 67.04 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 120.732 0.301 . . . . 0.0 110.255 175.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -57.64 -44.02 85.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.642 -175.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -67.6 -40.27 84.75 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.969 -178.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 51.6 mtm-85 -69.74 -40.23 76.3 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.52 0.2 . . . . 0.0 111.138 -177.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.652 ' O ' HG23 ' A' ' 33' ' ' VAL . 81.6 t -60.57 -43.7 95.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 175.103 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.3 m -62.16 -38.23 88.25 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.198 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.44 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 95.1 m-20 -61.79 -37.13 83.21 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.25 0.547 . . . . 0.0 110.382 177.362 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.05 -44.92 52.54 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.211 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.652 HG23 ' O ' ' A' ' 29' ' ' VAL . 61.8 t -61.58 -39.94 84.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.832 0.349 . . . . 0.0 110.544 -178.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 12.7 pt-20 -68.72 -38.46 80.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.91 178.162 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -72.38 -43.28 64.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.821 0.343 . . . . 0.0 110.935 -179.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.665 ' HB2' HG11 ' A' ' 70' ' ' VAL . 88.7 mt -66.15 -31.15 71.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.595 -177.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.518 ' HG ' HG12 ' A' ' 70' ' ' VAL . 11.3 mt -86.03 4.62 37.12 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -177.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.552 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 12.4 t70 -75.46 138.18 41.45 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.233 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.2 t -53.95 -37.71 64.17 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.389 -178.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 73.2 mtm180 -68.54 -46.52 69.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.393 0.616 . . . . 0.0 110.414 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.444 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.2 t -71.41 -29.46 35.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.209 -174.04 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.552 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 78.6 mtp180 -65.38 -21.96 66.74 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.213 177.344 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 25.2 mtm180 -90.12 -17.09 28.3 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.646 0.239 . . . . 0.0 111.646 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.3 p -83.64 159.17 61.59 Favored Pre-proline 0 C--N 1.326 -0.42 0 C-N-CA 121.238 -0.185 . . . . 0.0 110.89 177.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.45 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 35.8 Cg_endo -65.09 159.45 46.63 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.659 2.24 . . . . 0.0 112.512 177.632 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.415 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.7 OUTLIER -61.76 -39.73 92.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.22 -177.749 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 5.9 m -58.26 -40.96 83.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.278 -177.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 63.7 m -62.97 -46.64 86.76 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.736 177.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.542 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 80.7 mttt -56.99 -49.01 77.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.313 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 46' ' ' THR . 91.2 t -64.2 -45.02 97.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.268 -176.091 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 17.8 m170 -64.84 -38.93 92.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.017 -178.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -64.14 -42.93 96.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.277 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 87.7 mt -65.71 -37.97 87.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.848 -179.452 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -60.84 -42.24 97.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.005 174.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.4 t -69.59 -13.67 62.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.631 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.8 mmpt? -85.6 -3.04 58.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.626 175.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.1 17.37 40.68 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.637 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.2 mp -88.38 152.53 21.85 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.397 0.618 . . . . 0.0 111.934 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.2 m -93.52 164.91 13.0 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.743 175.443 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.23 -37.46 74.9 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.897 0.379 . . . . 0.0 110.839 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.443 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 1.6 mp0 -62.44 -46.87 86.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.42 178.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -65.63 -40.5 92.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.621 -177.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.4 HG23 HD12 ' A' ' 53' ' ' LEU . 87.8 mt -64.64 -45.8 94.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.608 177.124 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 31.3 t -56.68 -44.76 81.78 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.165 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -68.27 -45.86 71.97 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.066 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 69' ' ' LYS . . . -57.76 -40.76 80.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.737 0.303 . . . . 0.0 111.473 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.416 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.2 m-85 -60.04 -45.41 92.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.654 176.099 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.3 m -65.32 -33.08 75.13 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.229 0.538 . . . . 0.0 109.803 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 66' ' ' ALA . 27.0 mmmt -62.06 -35.77 79.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.937 177.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.665 HG11 ' HB2' ' A' ' 36' ' ' LEU . 22.1 m -89.89 5.37 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.822 0.344 . . . . 0.0 111.577 -176.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 94.66 13.5 53.31 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.875 176.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -119.42 90.81 43.21 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -72.43 102.31 1.37 Allowed 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 121.849 1.699 . . . . 0.0 112.053 -178.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -111.21 138.42 47.67 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.837 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 32.9 p -76.74 158.9 30.61 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.516 178.057 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 49.5 tp -62.99 -32.96 74.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.146 0.498 . . . . 0.0 109.947 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -58.72 -45.29 89.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.758 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.2 mm-40 -59.14 -48.76 80.43 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.521 178.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.7 mm -60.51 -44.19 95.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.678 -177.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -63.14 -44.04 96.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.932 177.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -60.99 -43.0 99.47 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.109 178.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 77.0 mt -66.68 -36.58 77.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.942 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 83.6 mt -77.74 -24.66 48.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.403 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 51.8 p . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.613 -0.708 . . . . 0.0 110.317 179.378 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.6 pttp . . . . . 0 N--CA 1.477 0.922 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.15 128.61 16.85 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.447 2.098 . . . . 0.0 111.989 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -95.56 93.87 7.43 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.288 0.565 . . . . 0.0 110.225 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.5 t -93.84 -56.93 4.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.749 178.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -100.88 -173.79 2.47 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.22 176.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 40.0 m80 -80.3 -43.91 20.48 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.601 -0.439 . . . . 0.0 110.745 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.533 HG23 ' H ' ' A' ' 24' ' ' GLU . 9.9 t -170.57 162.25 7.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.762 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -61.26 -34.4 75.1 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.491 176.663 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.8 t -61.92 -30.12 70.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.975 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.553 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 34.0 tt0 -71.55 -47.74 53.14 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.429 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -66.08 -36.72 83.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -62.92 -45.92 90.25 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.242 178.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 64.1 pttt -70.8 -32.23 69.25 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.9 -177.719 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.553 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 29.0 mtm180 -62.52 -47.36 84.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.799 0.333 . . . . 0.0 110.379 178.124 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.516 ' O ' HG23 ' A' ' 33' ' ' VAL . 75.6 t -65.0 -39.89 87.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.075 177.308 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.0 m -58.04 -46.57 85.13 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.775 177.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -63.02 -36.47 83.68 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.172 178.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.405 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -71.68 -44.92 63.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.05 -179.693 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.516 HG23 ' O ' ' A' ' 29' ' ' VAL . 82.2 t -61.18 -43.13 95.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.55 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -68.36 -35.53 77.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.9 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -72.43 -43.76 63.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.813 0.34 . . . . 0.0 110.677 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.68 ' HB2' HG11 ' A' ' 70' ' ' VAL . 86.6 mt -64.8 -29.95 70.94 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.563 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 37' ' ' LEU . 19.6 mt -85.04 7.69 20.54 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.088 -176.103 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.658 ' OD2' ' HG2' ' A' ' 40' ' ' ARG . 9.4 t70 -85.37 139.06 31.86 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.104 177.317 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.649 ' O ' ' HG3' ' A' ' 43' ' ' ARG . 27.1 t -55.52 -41.15 72.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.238 -178.068 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.658 ' HG2' ' OD2' ' A' ' 38' ' ' ASP . 11.0 ptm180 -67.81 -32.56 73.21 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.035 0.445 . . . . 0.0 110.646 -177.165 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.567 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 98.8 t -78.98 -33.18 15.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.444 -178.34 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 82.7 mtp180 -66.56 -22.04 66.15 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.909 175.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.649 ' HG3' ' O ' ' A' ' 39' ' ' SER . 67.9 mtt180 -86.15 -18.32 32.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.464 -178.659 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.08 158.73 58.15 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 121.187 -0.205 . . . . 0.0 110.822 177.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.37 154.02 73.66 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.381 2.054 . . . . 0.0 112.015 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -34.43 73.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.952 -177.722 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.6 p -58.54 -43.1 89.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.843 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 62.0 m -64.78 -44.67 89.24 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.124 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.567 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 82.9 mttt -56.98 -49.38 75.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.078 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 62.3 t -67.73 -43.62 86.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.009 -176.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 25.2 m170 -65.04 -36.68 85.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.595 -177.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.45 ' O ' ' HG3' ' A' ' 56' ' ' LYS . 72.6 t80 -69.94 -45.45 67.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.45 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 98.9 mt -62.87 -40.84 98.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.075 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.423 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 46.5 tptt -62.96 -40.0 96.36 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.427 177.582 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.3 t -70.79 -13.78 62.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.637 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' A' ' 52' ' ' PHE . 39.4 mtpt -86.12 -2.8 58.67 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.189 177.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 102.04 9.22 42.98 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.886 177.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.472 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.9 mp -80.6 156.01 26.62 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.44 0.638 . . . . 0.0 111.62 178.515 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.422 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 20.1 m -98.71 168.89 9.86 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.538 174.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.18 95.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.686 0.279 . . . . 0.0 111.113 -177.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -60.53 -40.85 93.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.938 177.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.422 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 6.3 mm-40 -63.1 -47.97 80.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.961 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 61.9 mt -64.65 -45.41 95.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.72 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.6 t -56.98 -45.02 83.25 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.946 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -67.76 -47.02 70.42 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.909 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.552 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -57.19 -47.26 81.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.052 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.578 ' O ' HG22 ' A' ' 70' ' ' VAL . 2.7 m-85 -56.44 -44.23 80.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.105 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.1 m -66.15 -33.54 76.01 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.807 0.337 . . . . 0.0 110.65 -177.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.492 ' HE3' HG21 ' A' ' 33' ' ' VAL . 22.4 mtmt -70.91 -30.95 67.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.795 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.68 HG11 ' HB2' ' A' ' 36' ' ' LEU . 7.9 m -83.47 -0.83 5.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.848 0.356 . . . . 0.0 111.287 -177.518 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 96.28 19.87 26.91 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.483 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -127.81 91.3 45.57 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 177.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.84 101.14 1.15 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 121.892 1.728 . . . . 0.0 112.57 -175.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -109.46 139.35 44.55 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.044 176.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 34.7 p -82.45 164.55 20.89 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.113 176.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.1 tp -63.08 -32.73 74.18 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 176.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -59.52 -45.62 91.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.475 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -58.69 -46.94 86.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.216 178.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 41.6 mm -61.59 -45.36 98.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.786 -177.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -64.14 -39.53 94.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.998 0.428 . . . . 0.0 110.479 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -59.89 -48.63 80.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.898 177.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.3 mt -69.85 -33.37 55.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.828 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 75.5 mt -82.97 1.64 38.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.745 0.307 . . . . 0.0 111.598 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 26.2 t . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.577 -0.725 . . . . 0.0 109.264 176.026 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.443 ' HD3' ' O ' ' A' ' 15' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 120.603 0.24 . . . . 0.0 110.55 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.405 ' HB2' HG12 ' A' ' 18' ' ' VAL . 73.4 Cg_endo -76.25 155.94 37.36 Favored 'Trans proline' 0 N--CA 1.461 -0.396 0 C-N-CA 122.899 2.399 . . . . 0.0 112.452 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -96.05 12.33 30.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.595 0.712 . . . . 0.0 110.096 176.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.405 HG12 ' HB2' ' A' ' 16' ' ' PRO . 2.9 p -109.95 115.59 50.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.059 178.382 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -137.86 147.45 44.5 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.561 -178.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -102.64 -59.76 1.65 Allowed 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 174.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.1 m -83.08 88.29 6.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.386 -178.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.42 ' O ' ' HG2' ' A' ' 25' ' ' ARG . 87.0 m-70 -73.12 -27.07 61.48 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.915 -178.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 32.2 t -62.33 -29.69 70.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.737 178.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.516 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 43.0 tt0 -65.82 -47.39 75.22 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.971 -0.291 . . . . 0.0 110.531 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.42 ' HG2' ' O ' ' A' ' 22' ' ' HIS . 29.0 ptt180 -68.43 -36.87 79.67 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.465 -0.494 . . . . 0.0 109.888 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -64.43 -43.94 92.73 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.944 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 63.6 pttt -67.27 -32.53 73.61 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.387 -179.017 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.516 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 21.2 mtm180 -65.46 -45.52 83.42 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.645 ' O ' HG23 ' A' ' 33' ' ' VAL . 73.3 t -60.63 -46.39 95.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.843 175.311 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.1 t -59.68 -42.83 93.82 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.171 -179.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -61.83 -36.85 82.39 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.051 0.453 . . . . 0.0 110.632 177.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.447 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -72.28 -41.86 66.21 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.878 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 29' ' ' VAL . 93.6 t -61.0 -46.55 96.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 120.869 0.366 . . . . 0.0 110.246 179.066 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -68.75 -33.65 74.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.815 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -71.42 -43.59 66.48 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.056 0.455 . . . . 0.0 110.615 179.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.635 ' HB2' HG11 ' A' ' 70' ' ' VAL . 93.2 mt -66.81 -32.24 73.4 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.884 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.2 mt -88.69 6.31 39.09 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -77.24 138.18 39.26 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.519 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 48.7 m -59.81 -33.93 72.39 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 -176.088 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.529 ' HG2' HG23 ' A' ' 41' ' ' VAL . 7.5 ptp180 -70.63 -40.58 73.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.069 0.461 . . . . 0.0 110.142 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.529 HG23 ' HG2' ' A' ' 40' ' ' ARG . 47.6 t -80.32 -26.96 11.7 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.856 -173.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.519 ' HG2' ' O ' ' A' ' 39' ' ' SER . 37.5 ptt180 -64.37 -20.29 66.03 Favored 'General case' 0 C--N 1.318 -0.799 0 O-C-N 121.738 -0.601 . . . . 0.0 111.222 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -83.43 -17.77 40.99 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -176.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.519 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -85.98 169.84 14.46 Favored Pre-proline 0 CA--C 1.536 0.442 0 O-C-N 122.44 -0.163 . . . . 0.0 111.348 -176.118 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.519 ' HD2' HG22 ' A' ' 44' ' ' THR . 44.2 Cg_endo -69.14 162.88 39.94 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.467 2.111 . . . . 0.0 112.191 174.455 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.46 -45.01 73.59 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.834 -176.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.1 m -58.44 -38.01 76.6 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.95 -174.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.8 m -60.27 -42.86 96.3 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 121.114 0.483 . . . . 0.0 110.873 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.493 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 25.3 mttm -63.71 -45.0 91.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.516 -178.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 60.3 t -63.17 -43.25 98.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.653 -178.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -64.59 -37.62 88.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.658 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -67.27 -46.27 74.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.531 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 96.2 mt -61.86 -39.62 92.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.746 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 51.1 tptt -59.87 -42.81 94.53 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.518 175.078 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.0 t -70.97 -19.32 62.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.841 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 55.3 mmtt -82.04 -3.56 54.86 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.989 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 102.14 9.0 43.29 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.566 -0.826 . . . . 0.0 112.824 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.493 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.4 mp -82.55 149.36 27.54 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.381 0.61 . . . . 0.0 111.315 179.124 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.417 ' H ' ' HG3' ' A' ' 62' ' ' GLU . 39.6 m -94.18 169.58 10.14 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.559 174.239 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.1 -37.78 77.96 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.861 0.363 . . . . 0.0 110.875 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.21 -44.85 92.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.401 177.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.421 ' H ' ' HG2' ' A' ' 62' ' ' GLU . 4.5 mm-40 -63.17 -48.29 79.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.877 -178.572 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 61.3 mt -63.38 -43.54 98.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.946 -178.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 52.6 t -57.51 -44.1 84.75 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.848 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -68.57 -48.46 64.17 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.905 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.18 -41.11 78.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.883 -178.027 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.424 ' O ' HG22 ' A' ' 70' ' ' VAL . 6.6 m-85 -61.26 -45.9 92.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.849 0.357 . . . . 0.0 110.635 177.257 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.5 m -63.08 -35.35 79.95 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.105 0.479 . . . . 0.0 110.125 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.409 ' HB2' HG22 ' A' ' 33' ' ' VAL . 29.0 mmtt -60.93 -36.46 79.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.45 178.344 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.635 HG11 ' HB2' ' A' ' 36' ' ' LEU . 18.6 m -90.6 9.59 3.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.543 -175.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.62 16.07 57.32 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.799 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.404 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 6.5 tp-100 -121.75 90.64 48.39 Favored Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 177.344 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.07 95.86 0.85 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 121.955 1.77 . . . . 0.0 112.588 -176.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -103.63 137.72 41.29 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.678 175.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 41.7 p -77.68 161.72 27.56 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.136 177.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.454 ' HG ' ' HE3' ' A' ' 80' ' ' LYS . 62.6 tp -61.65 -32.94 73.13 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.284 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -60.34 -44.25 95.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.997 176.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -57.45 -49.13 77.25 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.088 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 41.1 mm -60.77 -41.83 89.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.449 -177.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.454 ' HE3' ' HG ' ' A' ' 76' ' ' LEU . 96.1 mttt -61.18 -44.08 97.87 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.151 177.617 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.0 tpp180 -62.58 -46.14 89.7 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.598 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 83.9 mt -65.3 -36.56 78.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.131 -178.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 72.2 mt -80.91 -4.57 55.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.617 0.246 . . . . 0.0 111.638 178.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 19.9 t . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.732 -0.652 . . . . 0.0 109.629 178.033 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.6 mttt . . . . . 0 N--CA 1.479 1.011 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -80.56 122.43 4.5 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 122.685 2.256 . . . . 0.0 112.155 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -85.19 87.61 7.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.305 0.574 . . . . 0.0 110.238 -178.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 21.2 t -115.67 -23.06 4.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.5 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -72.16 109.53 6.0 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.896 -178.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 65.08 84.13 0.16 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.197 -178.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 31.4 m -109.56 -67.81 0.96 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.354 177.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -73.3 -34.02 65.5 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.705 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.8 p -56.87 -37.25 71.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.219 -178.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.483 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 8.2 mm-40 -69.29 -46.73 66.48 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.987 -175.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.437 ' O ' HG23 ' A' ' 29' ' ' VAL . 7.3 ptm180 -69.73 -37.32 76.48 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.284 -0.566 . . . . 0.0 109.929 176.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -62.94 -43.6 98.34 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.364 -177.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -65.16 -35.02 79.78 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.259 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 21.2 mtm180 -70.04 -41.55 74.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.344 178.285 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.464 ' O ' HG23 ' A' ' 33' ' ' VAL . 69.3 t -61.1 -44.52 98.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.09 174.353 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.3 m -60.84 -43.29 98.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.837 178.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -61.75 -35.84 79.28 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.068 0.461 . . . . 0.0 110.681 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.48 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -72.07 -44.8 62.74 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.953 178.347 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.564 HG13 HG12 ' A' ' 70' ' ' VAL . 67.7 t -60.98 -43.42 96.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.684 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -67.88 -35.9 79.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.67 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -72.26 -43.7 63.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.902 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.688 ' HB2' HG11 ' A' ' 70' ' ' VAL . 93.1 mt -65.12 -31.35 72.5 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.453 -178.77 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.402 ' HA ' HD23 ' A' ' 37' ' ' LEU . 11.8 mt -85.79 -0.68 55.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.222 -0.444 . . . . 0.0 112.086 -176.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -69.26 138.18 53.71 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.402 ' HA ' ' HG2' ' A' ' 42' ' ' ARG . 11.8 m -63.05 -30.5 71.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.843 0.354 . . . . 0.0 111.526 -175.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -69.34 -38.3 78.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.365 0.603 . . . . 0.0 110.39 175.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.7 t -79.24 -36.35 18.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.251 -172.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.402 ' HG2' ' HA ' ' A' ' 39' ' ' SER . 17.2 ptp180 -62.13 -20.28 63.91 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 120.859 0.361 . . . . 0.0 110.796 176.577 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 43' ' ' ARG . 40.7 ttm180 -85.21 -18.92 32.59 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.586 -178.51 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.602 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -89.13 168.38 15.54 Favored Pre-proline 0 CA--C 1.536 0.405 0 CA-C-N 116.85 -0.159 . . . . 0.0 110.989 -177.657 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.602 ' HD2' HG22 ' A' ' 44' ' ' THR . 49.2 Cg_endo -68.18 156.88 64.13 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.695 2.264 . . . . 0.0 111.975 176.339 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.451 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -68.12 -33.97 75.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.065 -177.491 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.531 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 20.6 m -58.28 -40.75 82.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.518 -177.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 54.7 m -59.84 -48.02 83.36 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.089 178.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.483 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 2.2 mttp -58.17 -48.8 79.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.21 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 58.3 t -64.02 -41.58 92.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.747 -175.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -65.12 -39.28 92.85 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.368 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -65.18 -48.81 72.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.48 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 85.0 mt -62.68 -39.56 94.32 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.045 -177.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -60.51 -42.83 97.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.021 0.439 . . . . 0.0 110.236 175.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 45.7 m -68.77 -19.71 64.32 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.827 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -80.83 -8.22 59.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.732 176.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.52 8.32 37.99 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.826 177.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.408 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 5.5 mp -80.07 144.72 32.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.252 0.549 . . . . 0.0 111.842 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.425 ' O ' HG13 ' A' ' 63' ' ' ILE . 6.1 m -86.46 165.42 16.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.37 174.202 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.25 -38.8 84.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.994 0.426 . . . . 0.0 110.929 -178.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -65.49 -37.55 87.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.909 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -67.1 -48.05 69.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.54 177.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.429 HG23 HD12 ' A' ' 53' ' ' LEU . 73.7 mt -59.31 -44.89 93.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.537 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.4 t -56.61 -43.35 80.07 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.788 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.704 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 32.5 tt0 -67.93 -48.31 66.3 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.925 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.484 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.25 -43.77 79.02 Favored 'General case' 0 CA--C 1.519 -0.24 0 O-C-N 123.147 0.279 . . . . 0.0 110.965 -178.399 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.562 ' O ' HG22 ' A' ' 70' ' ' VAL . 7.0 m-85 -58.57 -43.88 89.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.944 0.402 . . . . 0.0 110.954 177.568 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.8 m -65.96 -33.13 75.11 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.112 0.482 . . . . 0.0 110.618 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.704 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 25.2 mtpp -72.33 -30.35 64.68 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.91 -179.098 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.688 HG11 ' HB2' ' A' ' 36' ' ' LEU . 14.4 m -84.2 1.66 4.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.939 0.4 . . . . 0.0 111.201 -179.132 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.07 12.88 47.94 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.561 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -121.53 90.72 48.12 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.73 103.48 1.46 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 121.776 1.65 . . . . 0.0 112.001 -176.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.451 ' HE3' HG21 ' A' ' 46' ' ' THR . 71.3 mmtt -111.87 138.28 48.69 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.004 177.29 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 50.9 p -80.09 167.8 19.95 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.047 176.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.4 tp -63.56 -32.66 74.19 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -59.22 -45.46 91.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.832 176.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -56.31 -49.08 75.33 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.33 179.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 39.7 mm -63.45 -48.8 85.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.835 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -64.37 -39.63 94.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.41 -178.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -64.97 -44.69 88.54 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.116 0.484 . . . . 0.0 110.634 178.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.531 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 97.4 mt -65.48 -32.49 58.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.985 178.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 71.2 mt -79.36 -8.79 59.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.19 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 15.3 t . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.491 -0.766 . . . . 0.0 109.566 178.513 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 24.2 pttm . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 120.706 0.288 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.82 160.27 37.62 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.435 2.09 . . . . 0.0 111.535 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -97.83 9.31 42.99 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.933 0.397 . . . . 0.0 110.659 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 43.8 t -72.65 93.2 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 62.88 6.03 2.02 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.107 -172.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 60.3 -171.55 0.13 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 123.402 0.681 . . . . 0.0 111.542 178.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 40.8 m -69.29 109.03 3.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.121 0.486 . . . . 0.0 110.379 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -63.07 -41.33 99.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.599 -175.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.3 m -59.81 -35.54 74.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.356 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 27' ' ' LYS . 36.6 tt0 -70.11 -46.58 64.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.692 0.282 . . . . 0.0 110.821 -178.327 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.626 ' HB2' ' OE2' ' A' ' 62' ' ' GLU . 0.3 OUTLIER -68.07 -36.14 79.35 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.2 -0.6 . . . . 0.0 109.685 179.57 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -58.08 -44.19 87.43 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.986 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 64.7 pttt -71.91 -33.26 68.16 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.621 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.476 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 53.2 mtm180 -65.47 -48.0 74.17 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.705 0.288 . . . . 0.0 110.482 177.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.533 ' O ' HG23 ' A' ' 33' ' ' VAL . 76.5 t -61.74 -42.96 96.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.171 177.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.7 m -58.89 -45.66 89.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.908 178.385 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -62.0 -36.86 82.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.995 0.426 . . . . 0.0 111.135 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.75 -45.37 61.92 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.969 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 29' ' ' VAL . 90.6 t -61.22 -42.75 94.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.616 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.42 -35.82 76.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.168 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -71.21 -43.23 67.76 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.948 0.404 . . . . 0.0 110.553 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.721 ' HB2' HG11 ' A' ' 70' ' ' VAL . 88.9 mt -65.34 -29.19 69.89 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.284 179.21 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 37' ' ' LEU . 13.8 mt -85.67 6.35 27.98 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.261 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.693 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 13.4 t70 -79.72 133.56 36.35 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.661 -0.415 . . . . 0.0 109.939 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.5 m -52.96 -38.96 62.58 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 123.495 0.497 . . . . 0.0 112.044 -175.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -69.61 -36.68 76.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.128 0.49 . . . . 0.0 110.742 -179.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.526 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 61.5 t -76.8 -21.81 14.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.464 0.649 . . . . 0.0 110.385 -178.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.693 ' HG2' ' O ' ' A' ' 38' ' ' ASP . 20.4 mmm180 -64.08 -25.81 68.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.256 173.49 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -91.64 -17.98 24.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.542 -173.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.4 p -82.71 158.41 65.49 Favored Pre-proline 0 C--N 1.326 -0.447 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.123 -177.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -65.5 153.96 75.84 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.444 2.096 . . . . 0.0 111.754 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.57 -37.62 78.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.196 -177.08 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.513 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 18.9 m -58.76 -41.3 86.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.379 -177.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.6 m -63.57 -44.6 93.63 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.851 178.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.526 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 81.5 mttt -58.12 -48.26 80.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.398 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.451 HG12 HD21 ' A' ' 83' ' ' LEU . 85.2 t -66.96 -45.08 88.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.427 -176.122 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -64.38 -35.81 82.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.784 -177.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -67.14 -46.1 75.12 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.389 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 94.7 mt -64.25 -37.88 89.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.784 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.62 ' HD3' HD22 ' A' ' 83' ' ' LEU . 29.6 ttpt -63.26 -39.31 94.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.02 0.438 . . . . 0.0 109.94 176.25 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 44.3 m -68.71 -15.77 63.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.91 179.143 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -85.24 -4.08 59.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.613 175.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.09 1.68 55.94 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.854 -0.688 . . . . 0.0 112.694 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.476 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.4 mp -71.67 148.55 46.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.099 0.476 . . . . 0.0 111.364 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.464 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 9.4 m -90.79 165.98 13.36 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.286 175.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.86 -39.55 78.04 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.677 0.275 . . . . 0.0 111.683 -177.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -67.76 -35.07 78.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.39 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.626 ' OE2' ' HB2' ' A' ' 25' ' ' ARG . 4.1 mm-40 -64.96 -45.2 86.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.473 0.654 . . . . 0.0 109.48 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 67.8 mt -62.81 -42.1 95.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.291 177.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 32.1 t -56.8 -46.64 81.46 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.343 177.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -67.67 -48.13 67.5 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.712 -178.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.546 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.81 -45.76 82.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.295 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.549 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.1 m-85 -57.49 -45.1 85.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.898 0.38 . . . . 0.0 111.241 178.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.3 m -65.14 -33.23 75.52 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.94 0.4 . . . . 0.0 110.431 -177.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.514 ' HE3' HG21 ' A' ' 33' ' ' VAL . 21.3 mtmt -72.1 -27.73 62.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.607 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.721 HG11 ' HB2' ' A' ' 36' ' ' LEU . 8.4 m -88.79 7.49 3.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.736 0.303 . . . . 0.0 111.657 -179.024 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 93.05 17.21 44.48 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.743 176.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -127.22 91.08 47.38 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -68.19 105.72 1.25 Allowed 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 122.006 1.804 . . . . 0.0 112.195 -176.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -116.41 139.12 50.77 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.836 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 21.6 p -87.46 167.59 13.85 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.302 176.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 51.6 tp -63.63 -33.35 75.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.19 0.519 . . . . 0.0 109.676 176.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -57.77 -45.73 85.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.692 177.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -57.73 -48.36 79.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.994 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 36.5 mm -63.72 -46.02 95.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.813 -175.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -60.96 -43.05 99.31 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.07 0.462 . . . . 0.0 110.298 177.027 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.5 tpp180 -60.05 -45.12 93.89 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.434 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.513 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 86.9 mt -67.39 -35.07 72.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.964 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.62 HD22 ' HD3' ' A' ' 54' ' ' LYS . 84.3 mt -82.1 -0.18 43.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.382 179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 50.7 m . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.581 -0.723 . . . . 0.0 110.131 175.71 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.2 mttm . . . . . 0 N--CA 1.477 0.883 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -89.3 37.72 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.988 2.459 . . . . 0.0 112.457 179.086 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -110.98 16.68 21.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.939 0.399 . . . . 0.0 111.175 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 45.5 t -75.59 -35.52 31.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 173.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.423 ' HB3' ' NH1' ' A' ' 25' ' ' ARG . 7.4 pt-20 -83.22 78.71 9.57 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.46 -1.245 . . . . 0.0 109.737 173.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -79.73 -33.2 41.02 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.689 -175.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.624 ' HB ' ' OE2' ' A' ' 24' ' ' GLU . 12.2 p -126.1 98.47 5.5 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.341 0.591 . . . . 0.0 111.159 -176.763 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -70.07 -43.9 70.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.071 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.9 m -64.12 -38.64 91.79 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.864 -178.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.624 ' OE2' ' HB ' ' A' ' 21' ' ' THR . 10.9 mp0 -65.6 -44.82 85.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.532 177.532 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.423 ' NH1' ' HB3' ' A' ' 19' ' ' GLU . 27.3 ttm180 -63.45 -43.1 98.37 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.99 0.424 . . . . 0.0 110.231 176.089 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -59.21 -44.49 92.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.375 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.568 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 22.2 ptmt -69.76 -38.27 76.71 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.929 -0.308 . . . . 0.0 110.633 -177.481 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.579 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 60.2 mtm180 -63.84 -45.36 89.86 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.704 0.287 . . . . 0.0 110.626 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.487 ' O ' HG23 ' A' ' 33' ' ' VAL . 85.0 t -64.31 -41.44 92.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.415 177.184 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.4 m -62.08 -42.98 99.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.247 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -61.91 -35.65 79.0 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.172 0.51 . . . . 0.0 110.652 176.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.35 -44.91 61.93 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.243 179.312 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.493 HG13 HG12 ' A' ' 70' ' ' VAL . 71.5 t -60.87 -43.23 95.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.861 0.362 . . . . 0.0 110.527 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -68.31 -36.0 78.67 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.728 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 92.9 t80 -72.09 -44.17 63.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.841 0.353 . . . . 0.0 110.634 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.673 ' HB2' HG11 ' A' ' 70' ' ' VAL . 86.3 mt -62.74 -31.16 72.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.491 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 37' ' ' LEU . 14.0 mt -85.95 3.16 43.3 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -176.336 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.608 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 13.5 t70 -78.99 138.17 37.93 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.061 178.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.7 m -57.21 -38.07 73.17 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -176.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.5 ptp180 -68.6 -32.81 72.96 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.544 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 66.6 t -79.43 -31.16 14.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.261 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.608 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 86.9 mtt180 -61.82 -26.72 68.29 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.224 0.535 . . . . 0.0 109.646 173.048 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.445 ' HA ' ' NE ' ' A' ' 43' ' ' ARG . 6.8 tpm_? -85.71 -19.21 31.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.515 -178.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.1 p -82.6 155.18 68.67 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 122.057 -0.402 . . . . 0.0 110.688 178.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.421 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 35.3 Cg_endo -66.63 157.13 62.4 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.444 2.096 . . . . 0.0 111.777 175.261 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.413 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -59.65 -34.98 73.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.88 -178.076 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.7 p -58.58 -43.5 89.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.229 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 71.1 m -65.24 -44.37 88.42 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.846 179.155 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.554 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 81.3 mttt -57.35 -49.64 75.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.123 -179.239 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 46' ' ' THR . 64.7 t -66.22 -42.52 91.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.005 -176.419 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 24.9 m170 -64.73 -42.63 95.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.159 -178.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -66.12 -41.74 90.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.412 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 81.2 mt -63.05 -40.68 98.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.869 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.402 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 49.5 tptt -60.92 -40.84 94.73 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.103 0.478 . . . . 0.0 110.015 175.563 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.0 t -67.46 -20.08 65.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.907 178.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -81.11 5.76 15.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.232 178.107 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.04 12.62 58.72 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.58 177.059 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.579 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.5 mp -83.34 170.11 14.92 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.523 0.678 . . . . 0.0 111.804 179.748 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.442 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 16.8 m -117.71 164.28 15.22 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.78 -1.1 . . . . 0.0 108.562 173.036 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.08 -35.93 72.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.732 0.301 . . . . 0.0 111.685 -175.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.1 mp0 -69.07 -37.27 78.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.054 0.454 . . . . 0.0 110.703 -177.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.442 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 1.5 mm-40 -68.44 -44.34 75.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.505 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 75.9 mt -62.5 -41.58 92.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.438 179.175 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 49.7 t -56.71 -42.99 80.14 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.99 178.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.691 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 26.9 tt0 -68.27 -48.4 65.13 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.52 179.311 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.467 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.0 -44.69 78.88 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.277 -177.652 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.526 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.2 m-85 -57.73 -42.81 84.63 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.902 0.382 . . . . 0.0 111.123 177.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.1 m -66.69 -33.12 74.93 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.331 0.586 . . . . 0.0 110.588 -178.155 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.691 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 25.2 mtpp -71.87 -31.95 66.96 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.471 -178.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.673 HG11 ' HB2' ' A' ' 36' ' ' LEU . 11.7 m -82.7 -3.91 7.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.813 0.339 . . . . 0.0 111.08 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 101.73 16.46 24.04 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.8 177.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -123.92 91.39 49.69 Favored Pre-proline 0 C--N 1.322 -0.622 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -71.43 101.61 1.16 Allowed 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 122.033 1.822 . . . . 0.0 112.115 -176.496 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -108.37 147.93 30.84 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.489 177.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 43.1 p -85.47 162.43 18.96 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.001 175.311 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.4 tp -63.64 -33.17 75.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.265 0.555 . . . . 0.0 109.714 177.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -61.83 -42.36 98.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.55 178.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.418 ' O ' HG13 ' A' ' 82' ' ' ILE . 24.5 mm-40 -56.03 -49.6 73.24 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.593 177.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.7 mm -62.72 -49.69 82.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.965 -174.552 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -64.14 -39.29 93.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.892 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 18.3 tpp180 -64.28 -45.14 89.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.94 178.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 78' ' ' GLU . 96.8 mt -63.15 -34.11 64.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.847 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.7 mt -77.0 -20.8 55.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.255 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 47.3 m . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.885 -0.578 . . . . 0.0 110.481 -179.033 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm . . . . . 0 N--CA 1.48 1.034 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -80.89 165.33 19.81 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.424 2.083 . . . . 0.0 112.592 -178.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -92.26 16.15 12.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.537 0.684 . . . . 0.0 109.932 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 10.0 t -99.02 -6.84 9.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.336 -176.586 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -57.19 125.53 23.14 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 28.1 m80 65.93 99.4 0.04 OUTLIER 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 -170.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.3 p -59.89 172.23 0.79 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.841 -174.014 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -57.16 -44.45 83.48 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.051 -175.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.9 m -68.79 -32.8 72.79 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 121.242 -0.183 . . . . 0.0 111.22 -178.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.51 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 48.4 mt-10 -71.61 -47.92 51.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.942 0.401 . . . . 0.0 110.588 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.413 ' O ' HG23 ' A' ' 29' ' ' VAL . 18.7 ptp180 -68.87 -40.41 79.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.235 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -62.22 -43.02 99.77 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.242 -179.333 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -69.99 -34.3 73.16 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.925 -177.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.533 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 63.2 mtm180 -64.72 -48.37 74.87 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 120.922 0.392 . . . . 0.0 109.956 177.174 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.564 ' O ' HG23 ' A' ' 33' ' ' VAL . 86.0 t -60.7 -42.55 92.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.185 176.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.5 t -58.93 -45.9 89.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.028 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -61.26 -36.19 79.34 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.006 0.432 . . . . 0.0 110.668 178.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.32 -44.58 62.48 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.048 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 29' ' ' VAL . 92.7 t -60.96 -43.51 96.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.799 0.333 . . . . 0.0 110.536 -179.29 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -68.76 -34.5 75.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.982 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -72.94 -43.37 62.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.061 0.457 . . . . 0.0 110.711 178.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.691 ' HB2' HG11 ' A' ' 70' ' ' VAL . 84.2 mt -65.66 -29.44 70.0 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.602 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.5 mt -84.18 6.36 22.84 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.585 -177.205 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.492 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 22.9 t70 -83.57 136.76 34.13 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.874 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.1 t -53.8 -43.68 69.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.038 -177.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -68.55 -42.67 78.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.157 0.503 . . . . 0.0 110.396 -177.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.502 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 86.9 t -66.94 -34.54 70.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.034 -179.171 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.492 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 83.9 mtp180 -67.19 -22.94 65.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.247 177.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 57.8 ttp180 -84.3 -18.12 37.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.751 0.31 . . . . 0.0 110.936 -178.386 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -85.73 158.68 56.35 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.66 -0.246 . . . . 0.0 110.709 175.496 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.45 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 31.7 Cg_endo -65.43 157.04 60.21 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 122.671 2.247 . . . . 0.0 112.574 -179.472 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.476 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.5 OUTLIER -60.37 -40.26 90.19 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.055 -177.411 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 11.0 m -58.12 -42.43 85.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.913 -177.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.43 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 56.4 m -62.75 -45.47 92.57 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.885 178.102 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.509 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 81.3 mttt -57.07 -49.37 76.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.996 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 46' ' ' THR . 99.6 t -64.77 -43.19 96.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.064 -176.363 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 29.0 m170 -64.45 -37.97 89.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.962 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.453 ' CE1' ' HE2' ' A' ' 56' ' ' LYS . 43.8 t80 -70.17 -42.77 72.02 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.514 -178.648 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 89.9 mt -64.0 -34.76 78.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.952 0.406 . . . . 0.0 110.801 178.558 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.447 ' HE3' ' HB3' ' A' ' 54' ' ' LYS . 0.5 OUTLIER -60.73 -43.5 97.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.336 175.199 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 45.8 m -69.79 -13.76 62.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.086 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 65.6 mttm -78.85 -8.18 58.58 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.315 174.556 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.4 20.72 28.99 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.047 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.533 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.7 mp -86.55 154.8 20.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.07 0.462 . . . . 0.0 111.254 178.711 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.512 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 13.1 m -93.84 161.87 14.15 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.19 174.408 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.24 -35.23 71.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.22 0.533 . . . . 0.0 110.875 -179.07 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -67.9 -38.89 83.54 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.527 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.512 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 4.2 mm-40 -65.89 -44.88 84.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.978 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 75.1 mt -62.04 -43.81 98.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.368 178.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 39.7 t -57.45 -44.17 84.54 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.753 176.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 70.1 tt0 -67.21 -47.28 71.33 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.838 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.514 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -57.45 -47.84 80.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.259 -179.456 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.596 ' O ' HG22 ' A' ' 70' ' ' VAL . 6.2 m-85 -57.05 -44.54 83.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.988 0.423 . . . . 0.0 111.087 178.779 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.1 m -65.09 -32.77 74.64 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.996 0.427 . . . . 0.0 110.626 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.471 ' HE3' HG21 ' A' ' 33' ' ' VAL . 19.1 mtmt -71.27 -31.7 67.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.75 179.069 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.691 HG11 ' HB2' ' A' ' 36' ' ' LEU . 11.0 m -82.29 -3.55 7.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-O 120.859 0.362 . . . . 0.0 111.439 -177.334 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 100.12 17.19 25.68 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.261 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.405 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 5.5 tp-100 -126.68 91.15 48.0 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -72.73 99.24 1.04 Allowed 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 121.706 1.604 . . . . 0.0 112.239 -176.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.476 ' HE3' HG21 ' A' ' 46' ' ' THR . 73.3 mmtt -107.59 137.37 45.74 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.193 175.447 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.452 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 76.7 p -80.69 159.41 25.29 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.398 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.418 ' HG ' ' HE2' ' A' ' 80' ' ' LYS . 52.6 tp -61.42 -33.22 73.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.813 178.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -61.16 -43.58 98.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.917 178.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.452 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 21.6 mm-40 -59.13 -49.71 76.84 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.608 178.439 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 45.1 mm -62.66 -44.14 99.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.189 -174.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.418 ' HE2' ' HG ' ' A' ' 76' ' ' LEU . 61.6 mttm -63.89 -38.62 91.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.807 0.337 . . . . 0.0 110.927 -179.705 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 18.3 tpt180 -67.73 -44.48 77.51 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.775 177.531 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 78' ' ' GLU . 90.7 mt -62.16 -37.82 79.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.874 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.432 HD21 HG12 ' A' ' 50' ' ' VAL . 81.4 mt -78.21 -25.85 47.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.551 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 C--O 1.252 1.191 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.691 -178.556 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm . . . . . 0 N--CA 1.478 0.953 0 CA-C-O 121.127 0.489 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -82.66 165.12 15.99 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 123.234 2.622 . . . . 0.0 112.819 -173.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -90.33 13.57 15.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.204 0.526 . . . . 0.0 111.129 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 23.3 t -77.26 -24.34 14.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.516 0.674 . . . . 0.0 109.54 177.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -69.71 150.38 47.02 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.77 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 39.8 m80 -92.03 83.67 5.19 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.023 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 20.5 p -81.96 -77.42 0.22 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.083 0.468 . . . . 0.0 110.727 -178.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 38.6 p-80 -73.57 -22.46 60.06 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.376 -179.104 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.5 t -61.64 -35.04 76.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.555 -179.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.448 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 12.8 mt-10 -68.75 -47.74 65.52 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.941 -0.303 . . . . 0.0 111.043 178.765 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.52 ' HB2' ' OE2' ' A' ' 62' ' ' GLU . 0.1 OUTLIER -69.67 -37.38 76.67 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.35 -179.546 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -60.81 -44.04 97.41 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.213 -179.374 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 21.5 pttp -67.76 -34.24 76.42 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.436 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.476 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 39.8 mtm180 -66.05 -47.03 75.7 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.762 0.315 . . . . 0.0 110.523 179.233 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.498 ' O ' HG23 ' A' ' 33' ' ' VAL . 82.3 t -61.26 -42.68 94.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.215 177.098 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 35.8 m -58.69 -46.44 87.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.801 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -61.67 -36.0 79.58 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.083 0.468 . . . . 0.0 111.069 179.19 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.62 -44.41 62.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.006 179.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.517 HG13 HG12 ' A' ' 70' ' ' VAL . 75.6 t -60.82 -43.24 95.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.845 0.355 . . . . 0.0 110.575 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -69.22 -34.04 74.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.019 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -72.43 -43.52 63.71 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.885 0.374 . . . . 0.0 110.775 178.021 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.663 ' HB2' HG11 ' A' ' 70' ' ' VAL . 88.9 mt -66.51 -31.45 72.19 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.702 -177.344 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.6 mt -85.98 6.83 26.88 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.83 0.347 . . . . 0.0 111.918 -177.128 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.481 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 14.3 t70 -77.58 135.88 38.21 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 176.212 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.7 m -57.8 -36.17 71.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.74 0.305 . . . . 0.0 111.698 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -69.21 -41.56 76.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.196 0.522 . . . . 0.0 110.612 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.491 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 88.8 t -72.37 -32.93 44.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.876 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.481 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 24.6 mtp180 -66.08 -21.62 66.38 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.577 175.422 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -80.99 -17.88 48.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.132 -177.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -92.02 158.72 39.13 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.132 178.067 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.415 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 32.8 Cg_endo -64.82 156.9 59.27 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.885 2.39 . . . . 0.0 112.347 178.318 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.489 HG21 ' HE3' ' A' ' 74' ' ' LYS . 1.1 m -65.7 -38.08 88.23 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.599 -174.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.3 m -58.69 -38.43 78.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.951 0.405 . . . . 0.0 110.731 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 75.5 m -65.88 -44.25 85.92 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.827 176.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.491 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 86.8 mttt -57.27 -47.74 80.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.546 178.322 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 46' ' ' THR . 82.3 t -63.87 -46.1 95.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.167 -177.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -64.16 -37.21 86.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.983 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -64.08 -47.23 80.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.463 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 96.2 mt -64.04 -37.07 86.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.942 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -59.29 -43.26 92.57 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.13 0.49 . . . . 0.0 110.436 176.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.4 m -70.52 -16.6 62.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.505 -179.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.4 mmtp -85.41 -4.32 59.12 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 120.781 0.324 . . . . 0.0 111.199 177.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.81 13.71 31.27 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.73 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.476 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.0 mp -87.31 149.88 24.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.189 0.518 . . . . 0.0 111.709 178.059 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.44 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 16.8 m -94.04 167.63 11.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.519 175.44 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.73 -38.16 80.92 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -177.237 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -65.89 -37.51 86.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.112 0.482 . . . . 0.0 110.406 -179.078 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.52 ' OE2' ' HB2' ' A' ' 25' ' ' ARG . 3.1 mm-40 -64.46 -47.45 78.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.682 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.76 -45.47 98.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.627 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 53.7 t -58.13 -44.71 87.95 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.168 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.636 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 29.9 tt0 -67.48 -48.32 67.48 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.663 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.498 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.65 -44.02 80.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.458 -178.149 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.549 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.4 m-85 -58.53 -41.85 86.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.974 0.416 . . . . 0.0 111.207 179.057 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.8 m -65.77 -34.22 77.67 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.233 0.539 . . . . 0.0 110.422 -177.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.636 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 4.4 mtpm? -71.46 -31.2 66.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.957 179.249 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.663 HG11 ' HB2' ' A' ' 36' ' ' LEU . 11.0 m -83.48 4.13 2.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.811 0.338 . . . . 0.0 111.23 -178.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 94.02 17.45 40.6 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.606 176.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -127.1 91.55 46.42 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -70.28 98.26 0.73 Allowed 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 121.748 1.632 . . . . 0.0 112.328 -177.294 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.489 ' HE3' HG21 ' A' ' 46' ' ' THR . 71.6 mmtt -106.61 140.19 39.87 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.799 177.653 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 30.6 p -86.06 156.57 20.35 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.26 178.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 37.5 tp -62.42 -32.3 73.12 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -56.81 -45.48 82.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.501 176.116 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.419 ' O ' HG13 ' A' ' 82' ' ' ILE . 33.0 mt-10 -61.79 -48.76 79.18 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.71 177.33 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 46.4 mm -60.29 -46.27 95.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.839 -176.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -63.02 -38.06 89.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.948 178.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.1 tpp180 -67.9 -44.15 77.64 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.697 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 78' ' ' GLU . 93.6 mt -64.67 -36.49 77.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.845 -179.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.7 mt -78.98 -25.27 43.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.328 178.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 C--O 1.252 1.203 0 CA-C-O 119.053 -0.499 . . . . 0.0 110.578 -176.903 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 110.143 -0.318 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -65.09 115.37 3.26 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.204 1.936 . . . . 0.0 111.122 173.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -95.43 26.89 3.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.233 0.54 . . . . 0.0 111.215 -177.155 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.5 p -78.87 -10.73 12.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.95 0.881 . . . . 0.0 109.298 170.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -84.85 152.18 23.77 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.048 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 39.2 m80 70.95 153.59 0.12 Allowed 'General case' 0 N--CA 1.466 0.337 0 O-C-N 123.814 0.696 . . . . 0.0 111.144 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.6 p -80.83 83.6 6.54 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.372 0.606 . . . . 0.0 110.8 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.417 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . 22.6 p80 -71.15 -21.83 62.13 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.652 -178.532 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.9 p -63.86 -43.91 94.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.011 0.434 . . . . 0.0 110.393 175.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.483 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 64.2 mt-10 -68.17 -40.86 82.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.774 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.611 ' HB2' ' OE2' ' A' ' 62' ' ' GLU . 7.8 ptm180 -69.18 -38.95 78.95 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.211 178.091 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -63.52 -44.06 95.35 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.012 -178.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 14.2 ptmm? -63.78 -32.1 73.49 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.6 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.503 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 35.2 mtm180 -67.21 -44.5 79.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.402 177.444 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.628 ' O ' HG23 ' A' ' 33' ' ' VAL . 87.5 t -61.1 -46.84 95.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.156 177.552 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.1 m -62.4 -43.77 98.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.343 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -61.78 -36.04 79.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.124 0.488 . . . . 0.0 110.537 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.468 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -69.94 -43.89 70.69 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.584 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.628 HG23 ' O ' ' A' ' 29' ' ' VAL . 90.3 t -60.32 -46.23 95.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.011 0.434 . . . . 0.0 110.393 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.89 -33.7 74.2 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.26 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -72.1 -43.7 64.37 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.787 0.327 . . . . 0.0 110.789 177.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.711 ' HB2' HG11 ' A' ' 70' ' ' VAL . 95.1 mt -65.02 -31.3 72.46 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.213 -179.058 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 37' ' ' LEU . 16.5 mt -85.84 5.84 30.9 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.991 -177.025 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.61 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 10.6 t70 -74.28 134.0 42.62 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 177.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 m -52.15 -36.7 52.24 Favored 'General case' 0 C--N 1.328 -0.365 0 O-C-N 123.386 0.428 . . . . 0.0 111.652 -176.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 84.5 mtm180 -68.86 -44.42 73.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.181 0.515 . . . . 0.0 110.978 178.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.529 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.3 t -70.96 -26.69 28.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.681 -176.57 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.61 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 52.1 mtt180 -62.39 -22.49 66.19 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.421 174.327 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -90.27 -18.4 25.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.73 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.1 p -81.57 152.71 70.21 Favored Pre-proline 0 C--N 1.326 -0.433 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.63 177.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.416 ' HG2' ' OG ' ' A' ' 48' ' ' SER . 26.4 Cg_endo -63.8 154.53 69.06 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.309 2.006 . . . . 0.0 111.912 177.706 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.417 ' O ' HG23 ' A' ' 50' ' ' VAL . 1.5 m -59.5 -39.54 84.16 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.249 -177.401 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.418 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 13.8 m -58.26 -42.26 86.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.843 -179.038 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.416 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 74.4 m -62.47 -44.27 96.81 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.152 178.184 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.529 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 84.7 mttt -57.65 -49.97 74.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.26 179.345 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.584 HG12 HD21 ' A' ' 83' ' ' LEU . 61.6 t -64.69 -40.96 90.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.113 -176.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 36.7 m170 -64.92 -38.37 90.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.903 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -64.68 -47.0 80.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.885 0.374 . . . . 0.0 110.359 179.202 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.477 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 90.1 mt -62.59 -37.68 87.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.134 -179.076 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.607 ' HD3' HD22 ' A' ' 83' ' ' LEU . 38.3 ttpt -60.74 -42.19 96.85 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.313 0.578 . . . . 0.0 110.029 175.048 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.6 t -63.19 -24.77 68.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.811 178.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -85.1 7.21 22.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.391 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.8 7.94 70.43 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.623 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.503 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.4 mp -75.85 147.74 38.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.349 0.595 . . . . 0.0 111.125 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.504 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 14.9 m -91.2 162.9 14.45 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.786 174.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.01 -35.93 71.95 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.99 0.424 . . . . 0.0 111.14 -177.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -63.91 -41.61 97.62 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.247 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.611 ' OE2' ' HB2' ' A' ' 25' ' ' ARG . 3.1 mm-40 -63.63 -45.63 89.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.422 0.63 . . . . 0.0 109.543 -178.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.436 HG23 HD12 ' A' ' 53' ' ' LEU . 63.2 mt -62.99 -43.65 99.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.709 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 40.3 t -56.59 -46.18 80.96 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.139 178.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -68.01 -47.68 67.79 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.698 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.561 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.92 -46.31 82.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.902 -179.421 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.576 ' O ' HG22 ' A' ' 70' ' ' VAL . 2.6 m-85 -57.21 -45.72 83.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.247 179.316 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.9 m -65.25 -33.46 76.04 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.436 -177.626 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.496 ' HE3' HG21 ' A' ' 33' ' ' VAL . 25.9 mtmt -72.63 -27.04 61.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.996 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.711 HG11 ' HB2' ' A' ' 36' ' ' LEU . 8.6 m -87.05 3.45 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-O 120.841 0.353 . . . . 0.0 111.217 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 94.56 15.77 45.4 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.571 -0.824 . . . . 0.0 112.623 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -124.17 91.58 49.39 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -71.71 99.79 0.99 Allowed 'Trans proline' 0 N--CA 1.455 -0.758 0 C-N-CA 121.997 1.798 . . . . 0.0 112.332 -176.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -113.12 140.94 47.47 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.922 176.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 33.2 p -82.93 167.91 17.54 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.596 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 60.5 tp -63.0 -33.86 76.32 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 174.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -62.23 -43.63 98.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.458 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -57.06 -48.58 78.22 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.818 178.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.9 mm -61.33 -48.88 86.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.825 -176.174 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -64.64 -35.38 80.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.846 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.8 tpt180 -61.98 -45.77 92.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.247 0.546 . . . . 0.0 110.348 175.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.418 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 78.4 mt -68.1 -33.96 63.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.172 -178.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.607 HD22 ' HD3' ' A' ' 54' ' ' LYS . 87.5 mt -81.79 -20.68 38.66 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.906 178.293 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 71.5 m . . . . . 0 C--O 1.252 1.223 0 CA-C-O 117.963 -1.018 . . . . 0.0 111.684 179.236 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -74.91 115.19 4.21 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.371 2.047 . . . . 0.0 111.793 176.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -139.19 80.99 1.81 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.259 0.552 . . . . 0.0 110.394 -179.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 25.0 t -101.61 -31.63 3.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.244 176.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -70.09 153.47 43.13 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.805 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 10.9 p-80 -105.83 66.78 0.73 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.406 0.622 . . . . 0.0 110.167 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.2 m -66.35 -29.98 70.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.474 -175.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -67.53 -43.72 80.11 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 177.089 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.6 m -64.19 -34.33 77.84 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.37 177.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 66.7 mm-40 -64.8 -47.28 78.64 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.527 178.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.0 ptm180 -69.79 -37.09 76.19 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.387 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -64.67 -42.99 94.98 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.477 -179.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -67.16 -32.31 73.33 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 121.036 -0.265 . . . . 0.0 110.546 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 37.5 mtm-85 -68.45 -41.24 80.55 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 177.024 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.571 ' O ' HG23 ' A' ' 33' ' ' VAL . 69.2 t -60.91 -44.87 98.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.303 -0.408 . . . . 0.0 109.994 174.308 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.1 m -58.77 -42.2 88.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.021 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.512 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 23.3 m-80 -66.48 -34.76 78.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.051 0.453 . . . . 0.0 110.994 177.153 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.59 -43.99 65.27 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.108 177.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 29' ' ' VAL . 94.4 t -61.25 -40.93 87.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.847 0.356 . . . . 0.0 110.752 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 12.3 pt-20 -68.94 -37.49 78.91 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.563 178.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -72.28 -43.53 64.12 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.161 -179.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.592 ' HB2' HG11 ' A' ' 70' ' ' VAL . 74.0 mt -65.1 -31.68 73.0 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.45 -179.165 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.3 mt -85.79 6.48 27.79 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -176.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -76.87 139.05 40.13 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 177.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.411 ' HA ' ' HG2' ' A' ' 42' ' ' ARG . 20.9 t -59.45 -31.78 69.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.85 0.357 . . . . 0.0 111.057 -178.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -68.53 -42.69 78.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.372 0.606 . . . . 0.0 110.549 178.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 93.6 t -79.52 -32.26 14.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.271 -171.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.411 ' HG2' ' HA ' ' A' ' 39' ' ' SER . 17.3 ptp180 -67.92 -22.2 65.08 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.118 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -83.98 -18.09 38.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.72 0.295 . . . . 0.0 111.496 -178.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.09 162.93 50.35 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 116.638 -0.256 . . . . 0.0 110.756 177.231 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -63.97 157.9 50.33 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.626 2.217 . . . . 0.0 112.376 179.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.419 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -62.69 -35.18 78.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.075 -178.388 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.556 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 14.6 p -58.73 -43.66 90.26 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.402 -178.71 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.3 m -61.12 -45.93 92.68 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.965 178.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.465 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 82.0 mttt -57.34 -50.3 73.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.564 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 92.1 t -65.57 -44.91 93.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.201 -174.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 27.3 m170 -64.48 -35.99 82.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.005 -177.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -70.19 -38.53 75.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.277 -178.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 82.5 mt -69.83 -37.62 76.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.699 178.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -62.56 -38.26 89.34 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.162 0.506 . . . . 0.0 109.851 174.29 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.5 t -67.1 -19.96 65.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.441 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 69.0 mmtt -80.81 -8.37 59.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.768 177.232 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.07 15.67 38.08 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.601 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.9 mp -80.94 145.56 31.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.104 0.478 . . . . 0.0 111.402 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.2 m -82.28 163.46 21.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.539 173.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.73 -41.1 85.63 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.843 0.354 . . . . 0.0 111.246 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -70.55 -30.37 67.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.393 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -66.97 -45.73 76.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.225 0.535 . . . . 0.0 109.941 175.518 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 64.7 mt -62.67 -43.09 98.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.232 177.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 43.9 t -56.76 -43.62 80.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.836 176.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.98 -48.56 65.46 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.824 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.1 -42.62 81.09 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.281 -179.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.464 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.3 m-85 -60.8 -47.57 85.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.917 177.601 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 21.8 m -64.07 -34.96 79.21 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.04 0.448 . . . . 0.0 110.255 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mmmt -62.79 -35.39 79.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.602 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.592 HG11 ' HB2' ' A' ' 36' ' ' LEU . 22.4 m -87.42 7.23 2.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -176.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.6 18.39 48.64 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.657 177.439 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -123.75 90.97 50.18 Favored Pre-proline 0 C--N 1.322 -0.613 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 177.048 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -71.92 97.71 0.84 Allowed 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 121.903 1.736 . . . . 0.0 112.437 -176.032 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.419 ' HE3' HG21 ' A' ' 46' ' ' THR . 69.3 mmtt -106.97 137.96 44.06 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.848 176.119 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.7 p -80.64 162.05 24.4 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.409 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 64.7 tp -61.42 -33.61 74.0 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 175.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -60.18 -44.32 95.14 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.365 176.561 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.441 ' O ' HG13 ' A' ' 82' ' ' ILE . 8.7 mm-40 -61.21 -47.3 86.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.125 177.426 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.8 mm -60.13 -47.44 91.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.888 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -62.42 -40.85 97.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.13 0.491 . . . . 0.0 110.548 177.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -59.89 -47.02 87.45 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.747 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.556 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 88.8 mt -66.72 -31.64 54.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.09 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.1 mt -77.73 -12.57 59.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.204 178.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 25.9 p . . . . . 0 C--O 1.252 1.187 0 CA-C-O 119.036 -0.507 . . . . 0.0 110.577 177.305 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.9 pttp . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -74.97 140.18 25.24 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.016 1.81 . . . . 0.0 111.399 175.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -85.73 81.05 8.76 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.516 0.674 . . . . 0.0 109.762 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 40.8 t -81.99 -32.28 11.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.221 -178.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -98.97 154.74 17.84 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.287 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 42.7 p-80 -122.51 40.01 3.78 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 178.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.7 m -54.47 -31.97 56.83 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.307 -0.861 . . . . 0.0 112.314 -175.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.9 m170 -67.2 -40.6 86.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.216 0.531 . . . . 0.0 109.682 177.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 m -70.67 -29.88 66.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.024 177.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.604 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 61.9 mm-40 -65.63 -46.77 78.0 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.691 175.316 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.6 ' HB2' ' OE2' ' A' ' 62' ' ' GLU . 0.2 OUTLIER -67.99 -37.62 81.71 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.858 178.591 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.537 ' N ' ' HG3' ' A' ' 25' ' ' ARG . 35.2 tt0 -60.75 -44.05 97.18 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.551 -178.622 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 22.0 ptmt -68.28 -33.51 74.48 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.358 -179.457 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.604 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 34.8 mtm180 -63.19 -46.31 87.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 0.0 110.506 178.149 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.575 ' O ' HG23 ' A' ' 33' ' ' VAL . 97.9 t -61.74 -46.76 95.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.589 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.1 p -62.0 -38.51 88.88 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.247 -0.181 . . . . 0.0 111.428 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -61.15 -41.14 96.21 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.23 0.538 . . . . 0.0 110.37 176.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.69 -44.84 63.52 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.117 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.575 HG23 ' O ' ' A' ' 29' ' ' VAL . 87.0 t -61.49 -42.14 92.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.745 -179.225 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -69.23 -36.13 76.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.644 0.259 . . . . 0.0 110.829 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -71.97 -43.8 64.58 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.875 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.699 ' HB2' HG11 ' A' ' 70' ' ' VAL . 86.9 mt -65.74 -29.98 70.57 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.538 -178.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.509 ' HG ' HG12 ' A' ' 70' ' ' VAL . 12.2 mt -85.13 6.32 26.11 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -176.204 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.491 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 25.6 t70 -79.51 138.71 37.62 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.348 177.764 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.441 ' O ' ' HG2' ' A' ' 43' ' ' ARG . 23.1 m -57.04 -41.57 78.87 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -176.571 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.9 mmp_? -68.71 -38.55 80.34 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.087 0.47 . . . . 0.0 110.206 179.54 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.4 ' O ' ' NZ ' ' A' ' 49' ' ' LYS . 61.9 t -71.64 -25.15 24.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.387 179.109 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.491 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 71.0 mtp180 -72.75 -20.53 61.17 Favored 'General case' 0 C--N 1.319 -0.738 0 O-C-N 122.051 -0.406 . . . . 0.0 110.895 172.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.441 ' HG2' ' O ' ' A' ' 39' ' ' SER . 32.4 mmm180 -96.18 10.73 36.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.738 -177.596 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.502 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -110.12 168.08 8.15 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.677 178.249 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.502 ' HD2' HG22 ' A' ' 44' ' ' THR . 57.9 Cg_endo -70.73 156.26 61.14 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.425 2.083 . . . . 0.0 111.71 175.332 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.45 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -67.21 -34.01 76.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.898 0.38 . . . . 0.0 111.067 -177.138 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.489 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 11.5 p -58.39 -42.16 86.49 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.513 -176.733 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.9 m -61.6 -42.33 98.71 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.877 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.496 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 21.1 mttm -63.97 -47.41 80.5 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.654 -178.116 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.482 HG12 HD21 ' A' ' 83' ' ' LEU . 68.5 t -63.82 -44.41 98.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.743 -175.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -65.11 -40.52 94.64 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.743 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -62.53 -47.36 84.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.586 178.646 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 89.9 mt -64.58 -36.47 84.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.982 -178.624 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.481 ' HD2' HD22 ' A' ' 83' ' ' LEU . 78.9 tttt -64.3 -38.12 89.91 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 120.929 0.395 . . . . 0.0 110.241 176.509 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.2 t -66.68 -25.19 66.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.058 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.7 mmtt -78.12 -4.29 46.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.078 178.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.8 8.46 54.26 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.457 178.124 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.483 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.8 mp -80.43 146.62 31.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.454 0.645 . . . . 0.0 111.333 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.3 m -89.41 165.74 14.16 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.328 175.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.0 -37.27 76.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.962 0.41 . . . . 0.0 110.958 -178.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -64.13 -42.5 96.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.708 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.6 ' OE2' ' HB2' ' A' ' 25' ' ' ARG . 4.8 mm-40 -64.11 -44.81 91.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.38 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.45 HG23 HD12 ' A' ' 53' ' ' LEU . 77.2 mt -61.51 -42.89 95.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.299 178.065 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 43.5 t -57.88 -46.0 85.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.967 177.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -68.11 -45.11 74.6 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.247 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.44 -41.74 81.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.61 0.243 . . . . 0.0 111.207 -178.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.482 ' O ' HG22 ' A' ' 70' ' ' VAL . 8.9 m-85 -61.48 -46.33 90.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.052 0.453 . . . . 0.0 110.595 176.247 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 20.2 m -63.25 -32.84 74.35 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.089 0.471 . . . . 0.0 110.402 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 12.7 mmmt -66.74 -33.37 75.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.882 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.699 HG11 ' HB2' ' A' ' 36' ' ' LEU . 22.0 m -87.22 -0.17 7.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.729 0.299 . . . . 0.0 111.632 -177.428 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 99.27 16.29 30.29 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.579 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -122.86 91.43 49.73 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 178.364 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -70.84 100.57 0.96 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 121.786 1.657 . . . . 0.0 112.125 -177.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.45 ' HE3' HG21 ' A' ' 46' ' ' THR . 67.5 mmtt -105.22 142.6 34.71 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.679 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 41.6 p -83.12 156.01 23.51 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.289 178.1 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.87 -32.56 73.83 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 177.074 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.5 t30 -58.28 -45.78 87.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.748 177.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -59.3 -46.68 87.91 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.189 179.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 41.6 mm -60.3 -45.47 96.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.524 -177.515 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -64.29 -39.85 94.77 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.015 0.436 . . . . 0.0 110.858 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 64.5 ttt180 -60.11 -46.56 89.21 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.548 177.302 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.489 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 89.8 mt -67.35 -31.94 55.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.305 -0.862 . . . . 0.0 111.298 -179.377 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.482 HD21 HG12 ' A' ' 50' ' ' VAL . 90.4 mt -83.14 -14.25 53.95 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.332 179.001 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 21.8 p . . . . . 0 C--O 1.25 1.103 0 C-N-CA 123.653 0.781 . . . . 0.0 111.76 -179.242 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt . . . . . 0 N--CA 1.478 0.942 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -70.63 155.7 62.56 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.458 2.105 . . . . 0.0 111.494 175.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -147.39 100.7 3.29 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 7.8 p -129.81 -16.01 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.168 -176.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.46 119.67 10.19 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 120.795 0.331 . . . . 0.0 110.347 -179.369 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 -88.9 -72.93 0.52 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.185 -0.462 . . . . 0.0 109.912 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.2 m -148.01 17.01 1.09 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.189 0.518 . . . . 0.0 110.691 178.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 49.9 m-70 -69.95 -44.09 70.23 Favored 'General case' 0 CA--C 1.519 -0.237 0 O-C-N 122.118 -0.363 . . . . 0.0 110.738 -176.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -70.17 -33.07 71.31 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -176.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.422 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 9.2 tp10 -64.45 -48.29 75.82 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.043 177.283 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -67.06 -47.41 71.4 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.395 178.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -58.02 -43.86 86.99 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.498 -176.743 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.9 pttm -71.78 -33.82 68.91 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.953 -177.086 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.449 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 25.0 mtm180 -67.64 -48.1 67.69 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.772 0.32 . . . . 0.0 110.398 178.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.593 ' O ' HG23 ' A' ' 33' ' ' VAL . 98.3 t -60.94 -39.95 83.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.821 176.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.8 t -58.37 -45.45 88.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.502 178.006 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.441 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 93.3 m-20 -62.59 -37.74 87.43 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.733 178.564 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.66 -45.04 63.17 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.414 -179.375 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.593 HG23 ' O ' ' A' ' 29' ' ' VAL . 93.1 t -61.16 -41.91 91.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.87 0.367 . . . . 0.0 110.654 -178.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 10.4 pt-20 -68.93 -37.5 78.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.713 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -71.6 -43.01 67.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.936 0.398 . . . . 0.0 110.841 -179.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.672 ' HB2' HG11 ' A' ' 70' ' ' VAL . 84.0 mt -65.01 -30.39 71.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.577 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.3 mt -85.18 7.03 23.32 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -176.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.496 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 11.3 t70 -80.12 135.95 36.42 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 176.631 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.457 ' O ' ' HG3' ' A' ' 43' ' ' ARG . 15.4 p -57.12 -36.95 71.27 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.871 0.367 . . . . 0.0 111.48 -176.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 80.7 mtm180 -68.58 -38.96 81.11 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.273 0.559 . . . . 0.0 110.262 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 57.9 t -78.5 -25.03 13.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.228 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 79.7 mtp180 -72.69 -33.12 66.27 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.72 -0.392 . . . . 0.0 112.043 178.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 39' ' ' SER . 77.1 mtp180 -81.32 -10.25 59.6 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -173.044 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.522 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -79.41 173.54 7.56 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.76 -0.2 . . . . 0.0 110.632 177.087 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.522 ' HD2' HG22 ' A' ' 44' ' ' THR . 46.4 Cg_endo -68.62 155.65 68.19 Favored 'Trans proline' 0 C--O 1.239 0.54 0 C-N-CA 121.941 1.761 . . . . 0.0 111.249 171.003 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.37 -33.69 74.72 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.812 0.339 . . . . 0.0 111.019 -177.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.457 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 15.4 p -57.78 -42.64 84.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.259 -176.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.1 m -62.1 -43.82 97.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.111 -179.7 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -62.05 -47.43 84.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.476 -177.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 76.6 t -64.53 -43.52 96.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.73 -177.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 37.8 m170 -64.87 -37.71 88.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.504 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -63.86 -51.24 65.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.436 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.412 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 91.6 mt -62.24 -36.28 81.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.063 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.19 -43.42 95.92 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.23 0.538 . . . . 0.0 110.309 176.566 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.2 t -70.68 -14.21 62.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.238 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -86.73 0.75 54.11 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.843 0.354 . . . . 0.0 110.925 177.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.65 10.32 50.49 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.475 177.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.449 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.8 mp -88.56 148.02 24.31 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.372 0.606 . . . . 0.0 111.119 178.556 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.401 ' O ' HG13 ' A' ' 63' ' ' ILE . 50.9 m -95.28 173.13 7.7 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.942 -1.027 . . . . 0.0 109.771 176.085 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.83 87.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.924 0.392 . . . . 0.0 111.313 -177.513 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -67.58 -35.51 79.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.261 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -64.17 -45.98 86.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.459 0.647 . . . . 0.0 109.51 178.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 59' ' ' SER . 64.4 mt -65.19 -43.65 95.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.816 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 53.2 t -57.36 -43.22 83.32 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.915 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.47 -48.62 66.65 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.762 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.495 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -57.2 -47.62 80.81 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.198 -178.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.552 ' O ' HG22 ' A' ' 70' ' ' VAL . 5.1 m-85 -56.93 -45.83 82.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.278 179.115 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.6 m -64.91 -33.14 75.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.965 0.412 . . . . 0.0 110.584 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.1 mtmt -70.56 -31.62 68.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.973 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.672 HG11 ' HB2' ' A' ' 36' ' ' LEU . 14.3 m -83.68 -3.78 7.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.836 0.35 . . . . 0.0 111.457 -176.75 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 101.14 18.49 19.48 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.339 178.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -126.87 91.39 47.21 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 177.559 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -72.87 101.72 1.35 Allowed 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 121.711 1.608 . . . . 0.0 112.281 -176.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -111.26 140.51 45.76 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.64 175.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 47.3 p -81.92 165.52 20.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.956 0.408 . . . . 0.0 110.474 177.249 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.4 -33.02 74.64 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.784 177.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -63.49 -42.15 98.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.076 178.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.503 ' O ' HG13 ' A' ' 82' ' ' ILE . 2.7 mm-40 -58.14 -48.19 81.01 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.829 177.002 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 42.3 mm -62.69 -42.11 94.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.468 -178.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -61.96 -43.69 98.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.974 0.416 . . . . 0.0 110.572 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 27.2 tpt180 -60.67 -45.89 92.43 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.353 -0.839 . . . . 0.0 111.078 178.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 78' ' ' GLU . 82.8 mt -67.91 -35.6 72.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.102 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 71.5 mt -77.8 -13.4 59.9 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 -179.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 20.8 p . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.474 -0.774 . . . . 0.0 109.975 175.675 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.4 tptm . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -76.68 91.82 1.13 Allowed 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.27 1.98 . . . . 0.0 111.738 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.419 ' CG ' ' HA ' ' A' ' 21' ' ' THR . 41.3 tt0 -97.72 93.71 6.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.138 0.494 . . . . 0.0 111.328 -176.761 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.5 t -111.29 -55.85 4.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 171.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.502 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -109.16 -19.55 13.3 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.718 -1.128 . . . . 0.0 110.221 179.045 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 60.4 m80 -85.3 28.17 0.75 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.598 -178.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.471 ' HB ' ' HG2' ' A' ' 24' ' ' GLU . 19.5 m -56.63 133.96 54.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.701 179.218 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -63.97 -35.06 79.44 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.888 0.375 . . . . 0.0 110.015 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.7 m -60.09 -34.04 72.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.35 175.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.563 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 35.6 mm-40 -65.35 -47.84 75.04 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.898 179.06 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.47 ' HG3' ' N ' ' A' ' 26' ' ' GLU . 8.2 ptm180 -66.54 -37.25 84.6 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.703 179.637 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.47 ' N ' ' HG3' ' A' ' 25' ' ' ARG . 40.9 tt0 -62.06 -45.09 95.07 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.764 -179.231 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 13.7 ptmm? -73.01 -34.96 66.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.861 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.563 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 28.2 mtm180 -66.51 -41.11 89.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.502 0.191 . . . . 0.0 110.772 178.148 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 25' ' ' ARG . 70.6 t -63.09 -41.96 94.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 175.491 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.4 m -58.6 -46.96 85.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.262 176.561 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -62.37 -38.41 89.46 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.142 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.441 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -70.43 -45.34 66.05 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.168 -177.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.581 HG13 HG12 ' A' ' 70' ' ' VAL . 71.3 t -61.5 -44.68 98.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.877 0.37 . . . . 0.0 110.454 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -69.43 -33.66 73.29 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.924 -179.567 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -71.4 -43.07 67.51 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.953 0.406 . . . . 0.0 110.388 179.068 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.682 ' HB2' HG11 ' A' ' 70' ' ' VAL . 90.4 mt -64.27 -29.22 70.32 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.27 178.87 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.4 mt -85.35 6.5 26.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.168 -0.469 . . . . 0.0 112.084 -178.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -82.13 139.0 34.62 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.214 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.503 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 25.1 t -58.21 -37.4 74.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.628 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -68.18 -37.03 80.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.16 0.505 . . . . 0.0 110.438 -179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.572 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.0 t -79.33 -34.21 16.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.34 -176.535 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.503 ' HG2' ' O ' ' A' ' 39' ' ' SER . 39.6 ptt180 -68.26 -22.21 64.77 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.79 0.329 . . . . 0.0 110.543 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.2 ttp180 -84.75 -19.22 33.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.867 -178.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.22 161.35 49.44 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.92 178.336 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.415 ' HG2' ' OG ' ' A' ' 48' ' ' SER . 32.6 Cg_endo -63.53 155.99 59.43 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.687 2.258 . . . . 0.0 112.264 177.178 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.425 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.8 OUTLIER -61.69 -38.28 87.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.291 -177.509 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.8 m -58.76 -41.13 85.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.01 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.415 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 62.2 m -61.77 -45.99 91.51 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.801 178.393 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.572 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 80.1 mttt -56.91 -49.18 76.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.241 178.741 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.433 HG13 HG21 ' A' ' 63' ' ' ILE . 84.5 t -63.23 -45.28 98.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.143 -177.391 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 39.8 m170 -64.83 -37.24 86.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.964 -178.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -66.71 -45.99 76.98 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.691 0.281 . . . . 0.0 110.349 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 88.1 mt -62.23 -37.4 85.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.69 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.2 tppt? -59.79 -42.55 93.62 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.152 174.516 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.6 m -67.51 -15.32 63.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.973 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 27.6 mmtp -86.77 -4.6 59.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.901 177.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.15 7.68 55.93 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.858 -0.686 . . . . 0.0 112.753 178.328 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.453 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 5.1 mp -73.13 150.4 42.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.368 0.604 . . . . 0.0 111.602 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.6 m -90.88 161.28 15.29 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.362 -0.835 . . . . 0.0 108.78 173.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.27 -38.71 77.51 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.989 0.424 . . . . 0.0 110.498 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.474 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 1.8 mp0 -59.64 -43.16 93.95 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.716 177.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.11 -43.66 77.9 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.77 -178.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.433 HG21 HG13 ' A' ' 50' ' ' VAL . 74.7 mt -60.78 -44.34 97.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.079 176.746 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 52.9 t -59.37 -43.94 92.8 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.721 178.192 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.715 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 30.3 tt0 -67.53 -48.99 65.43 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.879 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.477 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.65 -45.24 81.74 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 120.54 0.21 . . . . 0.0 111.047 -178.379 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.569 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.7 m-85 -57.04 -44.95 83.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.927 0.394 . . . . 0.0 111.055 177.448 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.8 m -65.14 -33.14 75.32 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.251 0.548 . . . . 0.0 110.485 -177.311 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.715 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 20.7 mtpp -71.65 -32.34 67.82 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.797 -179.21 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.682 HG11 ' HB2' ' A' ' 36' ' ' LEU . 15.2 m -81.9 -4.41 7.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 121.049 -0.261 . . . . 0.0 111.314 -177.597 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 102.04 16.66 22.84 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.407 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.421 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 5.6 tp-100 -126.79 90.93 48.43 Favored Pre-proline 0 C--N 1.323 -0.587 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -74.02 99.43 1.17 Allowed 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 121.974 1.783 . . . . 0.0 112.268 -176.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.425 ' HE3' HG21 ' A' ' 46' ' ' THR . 72.7 mmtt -106.46 138.08 43.29 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.557 175.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.425 ' O ' HG12 ' A' ' 79' ' ' ILE . 63.7 p -77.32 156.31 31.41 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.26 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 37.8 tp -62.94 -32.69 74.06 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -60.79 -46.08 91.88 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.626 175.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -60.44 -43.76 96.48 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.383 178.357 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 75' ' ' THR . 45.7 mm -60.35 -43.25 93.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.533 0.206 . . . . 0.0 110.684 -178.208 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -63.98 -41.35 97.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.295 0.569 . . . . 0.0 110.649 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -59.8 -42.45 93.44 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.825 177.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 79.8 mt -73.91 -32.69 34.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.288 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 64.3 mt -80.92 -1.97 45.7 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.248 1.011 0 CA-C-O 119.144 -0.455 . . . . 0.0 110.485 175.857 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.41 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 49.5 mttp . . . . . 0 N--CA 1.476 0.873 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.11 102.94 0.22 Allowed 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 121.988 1.792 . . . . 0.0 110.185 167.399 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 15' ' ' LYS . 78.7 mm-40 -89.56 8.41 31.37 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -167.686 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.6 t -104.38 -56.08 5.31 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-O 121.182 0.515 . . . . 0.0 110.589 -179.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -102.57 -27.5 12.72 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.985 -178.127 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 65.82 -79.81 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 O-C-N 123.85 0.719 . . . . 0.0 111.417 -179.26 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.5 m -91.43 94.05 9.29 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.208 0.528 . . . . 0.0 110.852 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.498 ' O ' ' HG2' ' A' ' 25' ' ' ARG . 37.7 m80 -66.19 -32.26 73.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.441 177.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -60.96 -33.78 73.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.935 0.398 . . . . 0.0 110.361 178.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.562 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 36.7 tt0 -68.88 -45.11 71.85 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.44 -179.495 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.498 ' HG2' ' O ' ' A' ' 22' ' ' HIS . 25.0 ptt180 -67.56 -37.31 82.47 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.664 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -60.5 -44.86 95.54 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.258 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -71.44 -32.95 68.93 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.201 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.562 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 31.9 mtm180 -65.9 -44.22 85.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.746 -0.206 . . . . 0.0 110.65 177.651 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.566 ' O ' HG23 ' A' ' 33' ' ' VAL . 94.5 t -60.75 -44.56 97.6 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.159 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 174.659 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 29.6 m -58.71 -44.17 90.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.749 178.085 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -62.77 -37.07 85.17 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.169 0.509 . . . . 0.0 110.763 177.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.03 -44.41 63.44 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.914 -178.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.566 HG23 ' O ' ' A' ' 29' ' ' VAL . 92.9 t -61.38 -42.9 95.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.458 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.5 -36.79 76.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.662 0.268 . . . . 0.0 110.938 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -71.48 -42.95 67.43 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.945 0.402 . . . . 0.0 110.636 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.679 ' HB2' HG11 ' A' ' 70' ' ' VAL . 80.6 mt -66.97 -30.75 70.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.196 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.566 ' HG ' HG12 ' A' ' 70' ' ' VAL . 12.6 mt -85.38 7.49 22.3 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.628 -178.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -81.16 137.98 35.89 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.058 175.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.444 ' HA ' ' HG2' ' A' ' 42' ' ' ARG . 15.8 m -61.53 -36.45 80.61 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.773 -176.366 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.47 ' H ' ' HD2' ' A' ' 40' ' ' ARG . 3.6 mpt_? -70.33 -39.38 74.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.225 0.535 . . . . 0.0 109.66 -179.516 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.48 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 91.3 t -76.36 -36.78 30.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.603 -177.589 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.444 ' HG2' ' HA ' ' A' ' 39' ' ' SER . 40.2 ptt180 -65.91 -20.18 66.13 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 121.937 -0.477 . . . . 0.0 109.792 176.685 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 28.2 tpt180 -83.07 -19.03 37.61 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.545 179.45 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 p -82.4 161.18 60.31 Favored Pre-proline 0 C--N 1.33 -0.241 0 O-C-N 122.144 -0.347 . . . . 0.0 111.081 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -59.94 149.74 82.23 Favored 'Trans proline' 0 C--O 1.237 0.428 0 C-N-CA 122.641 2.227 . . . . 0.0 112.032 176.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.88 -36.39 76.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.247 -177.76 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.7 p -58.56 -42.61 88.34 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.121 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 52.0 m -62.06 -45.86 91.67 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.065 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.504 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 82.3 mttt -57.09 -49.91 74.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.326 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 81.3 t -63.58 -44.88 98.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.012 -177.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -64.83 -38.69 91.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.306 -177.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -64.63 -47.89 76.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.667 0.27 . . . . 0.0 110.469 178.454 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 86.1 mt -62.23 -41.05 98.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.203 -178.463 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.415 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 38.0 tptt -61.57 -42.27 98.6 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 120.923 0.392 . . . . 0.0 110.266 177.46 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.9 m -67.45 -17.33 64.66 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.106 179.262 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.18 -3.59 52.7 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.882 0.372 . . . . 0.0 110.982 177.018 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.24 8.34 47.41 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.922 176.326 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.531 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.4 mp -75.11 157.15 35.18 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.631 0.729 . . . . 0.0 111.821 -179.118 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.8 m -95.05 160.69 14.45 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.947 172.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.67 -37.69 76.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.897 0.379 . . . . 0.0 111.386 -177.107 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -70.66 -29.49 65.85 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.438 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -71.37 -44.36 65.16 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.073 0.463 . . . . 0.0 110.233 177.085 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 60.0 mt -62.49 -42.1 94.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.048 176.483 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 48.3 t -56.77 -46.29 81.55 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.267 -0.878 . . . . 0.0 110.963 178.197 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -66.59 -47.53 72.42 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.666 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.24 -42.07 80.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.595 -176.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.416 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.1 m-85 -61.45 -44.96 96.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.088 0.47 . . . . 0.0 110.78 176.391 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.1 m -64.71 -33.63 76.42 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.202 0.525 . . . . 0.0 110.297 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.7 mmmt -62.98 -36.56 83.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.38 178.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.679 HG11 ' HB2' ' A' ' 36' ' ' LEU . 19.7 m -89.61 3.69 6.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -174.528 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.06 18.42 29.29 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.275 -0.964 . . . . 0.0 112.9 177.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.404 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 5.7 tp-100 -126.77 90.83 48.69 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.202 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -71.6 100.34 1.03 Allowed 'Trans proline' 0 N--CA 1.461 -0.4 0 C-N-CA 121.955 1.77 . . . . 0.0 112.816 -175.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -108.33 146.38 33.05 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.989 176.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 39.1 p -89.37 165.84 14.11 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.593 177.65 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 61.0 tp -63.32 -35.19 79.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.277 0.56 . . . . 0.0 109.599 174.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.95 -40.5 96.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.594 178.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.477 ' O ' HG13 ' A' ' 82' ' ' ILE . 12.5 mm-40 -56.92 -49.27 76.12 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.592 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.5 mm -63.02 -45.44 98.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.742 -176.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -57.63 -42.53 83.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.145 0.497 . . . . 0.0 111.177 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -66.4 -48.02 71.43 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.771 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 78' ' ' GLU . 86.5 mt -62.25 -36.19 73.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.289 -178.102 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.7 mt -78.09 -25.79 47.76 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.078 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 69.9 m . . . . . 0 C--O 1.249 1.054 0 O-C-N 123.84 0.712 . . . . 0.0 112.288 179.47 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 64.1 pttt . . . . . 0 N--CA 1.48 1.038 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -84.28 27.58 0.6 Allowed 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.7 2.267 . . . . 0.0 112.119 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -111.91 67.97 0.66 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.732 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 38.1 t -95.24 -41.23 11.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 175.033 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -124.33 117.49 24.61 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.414 -1.266 . . . . 0.0 108.843 175.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.419 ' HB2' ' OG ' ' A' ' 23' ' ' SER . 12.6 p80 -87.11 77.47 9.1 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.547 0.689 . . . . 0.0 111.849 -175.501 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.4 p -70.98 -29.88 65.99 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.19 176.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 13.9 m170 -66.38 -37.34 85.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.144 178.59 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.419 ' OG ' ' HB2' ' A' ' 20' ' ' HIS . 16.8 m -67.2 -35.5 79.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.615 178.503 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.471 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 12.9 tp10 -63.69 -41.45 98.13 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.09 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -66.4 -45.0 81.48 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.173 174.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -57.57 -44.36 85.26 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.29 -178.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -71.1 -40.01 71.75 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.843 179.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.471 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 20.6 mtm180 -58.88 -48.97 79.5 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 120.893 0.378 . . . . 0.0 110.6 177.485 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.561 ' O ' HG23 ' A' ' 33' ' ' VAL . 99.2 t -63.12 -45.15 99.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.192 177.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.1 t -58.58 -45.23 89.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.728 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -62.12 -38.72 89.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.072 0.463 . . . . 0.0 110.768 179.321 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.23 -43.89 63.71 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.066 179.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 29' ' ' VAL . 69.2 t -60.95 -43.18 95.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.553 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -69.65 -35.45 75.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.724 0.297 . . . . 0.0 111.062 179.602 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -72.6 -43.13 63.74 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 120.991 0.424 . . . . 0.0 110.908 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.632 ' HB2' HG11 ' A' ' 70' ' ' VAL . 91.5 mt -65.71 -30.41 71.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.847 179.319 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.6 mt -85.82 7.15 25.0 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.526 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -78.76 138.87 38.43 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.835 0.35 . . . . 0.0 110.627 -178.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.605 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 14.9 t -57.87 -35.21 70.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.329 -178.499 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -69.87 -38.84 76.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.148 0.499 . . . . 0.0 110.984 178.338 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.6 t -79.39 -27.91 13.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.739 -174.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.605 ' HG2' ' O ' ' A' ' 39' ' ' SER . 39.0 ptt180 -64.13 -21.84 66.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.953 0.406 . . . . 0.0 110.735 178.583 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -88.27 -17.54 30.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.032 -179.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.8 p -86.01 157.04 57.51 Favored Pre-proline 0 C--N 1.326 -0.43 0 C-N-CA 121.055 -0.258 . . . . 0.0 111.089 179.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.423 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 35.7 Cg_endo -64.88 159.81 44.17 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.718 2.278 . . . . 0.0 112.149 177.182 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.576 HG21 ' HE3' ' A' ' 74' ' ' LYS . 1.3 m -59.8 -41.53 91.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.024 -178.222 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.459 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 10.1 m -58.65 -40.56 83.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.34 -176.142 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.6 m -63.57 -42.38 98.33 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 120.719 0.295 . . . . 0.0 110.999 177.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 45' ' ' PRO . 80.8 mttt -59.79 -48.32 82.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.124 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 58.5 t -65.84 -43.22 93.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.887 -177.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 37.1 m170 -62.84 -39.61 94.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.598 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -64.24 -51.08 65.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.554 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 94.9 mt -60.55 -38.69 85.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.969 -178.02 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.37 -44.18 97.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.165 0.507 . . . . 0.0 110.152 176.778 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 18.5 m -64.77 -19.34 65.76 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.445 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -85.22 -1.37 56.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.275 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 96.01 12.71 51.82 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.619 177.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.439 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.6 mp -81.57 152.63 27.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.051 0.453 . . . . 0.0 111.033 177.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.512 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 17.8 m -95.6 163.97 12.98 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.422 176.456 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.18 -37.57 75.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.889 0.376 . . . . 0.0 111.349 -177.719 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -65.01 -40.76 95.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.485 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.512 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 4.6 mm-40 -64.28 -45.1 89.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.309 0.576 . . . . 0.0 109.514 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 76.6 mt -63.03 -45.48 98.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.9 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 48.2 t -56.81 -45.29 82.35 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.298 -179.182 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -68.13 -47.36 68.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.806 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.13 -41.78 79.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.486 -179.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.418 ' O ' HG22 ' A' ' 70' ' ' VAL . 2.8 m-85 -59.32 -47.97 83.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.946 177.482 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.0 m -63.98 -32.63 74.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.23 0.538 . . . . 0.0 110.322 -179.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mmmt -65.51 -33.99 77.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.065 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.632 HG11 ' HB2' ' A' ' 36' ' ' LEU . 26.0 m -89.14 5.78 4.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.742 0.306 . . . . 0.0 111.701 -177.256 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.78 22.37 33.73 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.532 -0.842 . . . . 0.0 112.326 178.105 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -127.36 91.03 47.22 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 175.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -70.1 104.45 1.37 Allowed 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 121.788 1.659 . . . . 0.0 112.168 -177.043 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.576 ' HE3' HG21 ' A' ' 46' ' ' THR . 72.5 mmtt -115.12 137.52 51.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.318 176.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 73.9 p -81.76 162.3 22.97 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 178.691 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 55.1 tp -62.39 -33.14 74.18 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.417 0.627 . . . . 0.0 109.41 177.261 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -61.9 -45.2 94.75 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.553 177.445 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -59.41 -47.0 87.14 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.038 179.375 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 43.5 mm -59.53 -46.21 93.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.563 -177.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -64.48 -38.43 90.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.027 0.441 . . . . 0.0 111.192 178.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -66.03 -41.41 90.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.822 178.754 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.459 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 81.1 mt -67.1 -32.22 56.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.23 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 98.7 mt -78.13 -20.82 51.35 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.051 178.493 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 12.4 m . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.593 -177.567 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.2 pttp . . . . . 0 CA--C 1.531 0.227 0 CA-C-O 120.644 0.259 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.505 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 82.8 mtm-85 -67.8 -44.06 78.23 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 176.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.537 ' O ' HG23 ' A' ' 33' ' ' VAL . 87.6 t -61.41 -38.5 80.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.745 175.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.2 t -58.32 -45.66 87.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.413 177.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -61.87 -36.6 81.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.22 178.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.39 -45.25 55.88 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.235 -179.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 29' ' ' VAL . 94.7 t -62.4 -40.0 86.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.764 -178.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -68.92 -38.75 79.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.796 0.331 . . . . 0.0 110.753 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -71.74 -42.6 67.06 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.745 -178.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.676 ' HB2' HG11 ' A' ' 70' ' ' VAL . 89.8 mt -67.28 -30.92 70.93 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.155 179.448 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.48 ' HG ' HG12 ' A' ' 70' ' ' VAL . 9.6 mt -85.32 6.04 28.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.565 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.634 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 12.2 t70 -73.94 128.91 36.77 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -53.52 -44.0 68.78 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -175.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 86.1 mtm180 -69.11 -33.59 73.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.292 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.535 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 98.5 t -73.59 -28.68 25.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.159 0.504 . . . . 0.0 110.419 178.022 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.634 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 90.9 mtt180 -62.43 -22.26 66.05 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.042 0.449 . . . . 0.0 110.322 173.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 34.9 ttm180 -93.46 -17.07 23.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.332 -177.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.6 p -80.31 158.32 71.91 Favored Pre-proline 0 C--N 1.33 -0.277 0 O-C-N 122.269 -0.269 . . . . 0.0 110.654 174.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.411 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 36.9 Cg_endo -67.05 156.3 66.95 Favored 'Trans proline' 0 C--O 1.234 0.324 0 C-N-CA 122.595 2.196 . . . . 0.0 112.234 178.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.508 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -59.66 -37.91 80.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.924 -177.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.6 p -58.42 -42.77 87.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.466 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.9 m -63.97 -42.68 97.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.118 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.535 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 78.4 mttt -60.88 -49.45 77.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.284 178.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 46' ' ' THR . 63.7 t -65.18 -44.62 95.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.187 -174.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 15.7 m170 -63.31 -37.83 88.79 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.217 -177.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -70.57 -45.57 65.15 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.897 -178.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 91.8 mt -61.99 -40.19 94.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.049 -178.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.471 ' HD2' ' C ' ' A' ' 54' ' ' LYS . 0.9 OUTLIER -59.77 -43.7 94.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.323 0.583 . . . . 0.0 109.888 177.521 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.4 m -68.7 -14.36 62.97 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.396 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 35.5 mtpt -87.58 3.67 46.67 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.949 177.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.72 2.4 52.76 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.994 174.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.505 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.8 mp -78.24 154.66 30.83 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.372 0.606 . . . . 0.0 111.663 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.401 ' O ' HG13 ' A' ' 63' ' ' ILE . 16.2 m -95.9 161.22 14.09 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.309 173.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.9 -38.66 76.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.855 0.359 . . . . 0.0 111.284 -177.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.02 -37.42 87.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.988 178.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -71.53 -39.26 70.85 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.386 -179.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 59' ' ' SER . 80.6 mt -63.16 -43.96 99.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.189 176.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 40.7 t -56.71 -42.19 78.73 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.913 177.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -68.18 -48.54 64.99 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.917 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.21 -41.91 80.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.403 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.427 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.8 m-85 -58.81 -46.58 87.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.95 0.405 . . . . 0.0 110.83 176.353 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 20.8 m -65.21 -33.05 75.08 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.108 0.48 . . . . 0.0 110.081 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -63.28 -35.77 81.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.642 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.676 HG11 ' HB2' ' A' ' 36' ' ' LEU . 23.0 m -88.46 5.23 4.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-O 120.992 0.425 . . . . 0.0 111.643 -177.279 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 93.53 18.89 36.8 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.662 177.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -121.58 91.01 48.37 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.55 99.46 1.22 Allowed 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 121.982 1.788 . . . . 0.0 112.368 -177.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -109.85 144.29 38.51 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.645 176.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.435 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 24.3 p -81.79 157.81 24.35 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 175.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 53.6 tp -60.78 -32.66 71.97 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.107 0.479 . . . . 0.0 110.568 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -59.78 -42.19 92.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.745 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.435 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 58.1 mm-40 -59.47 -48.66 80.79 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.291 178.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 46.1 mm -60.36 -48.41 88.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.037 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -63.48 -38.14 90.0 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.861 0.362 . . . . 0.0 110.648 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.6 ttm180 -61.95 -48.71 79.17 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.924 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 78' ' ' GLU . 69.2 mt -64.34 -33.09 60.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.072 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.409 HD21 HG12 ' A' ' 50' ' ' VAL . 79.2 mt -79.2 -17.25 55.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.766 -179.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.6 p . . . . . 0 C--O 1.252 1.206 0 CA-C-O 118.308 -0.853 . . . . 0.0 110.621 179.598 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.8 pttt . . . . . 0 C--O 1.227 -0.099 0 CA-C-O 120.692 0.282 . . . . 0.0 110.598 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.465 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 83.3 mtm180 -69.93 -40.4 75.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.66 -179.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.494 ' O ' HG23 ' A' ' 33' ' ' VAL . 84.6 t -62.49 -42.24 95.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 175.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.6 t -61.95 -42.36 99.03 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.49 178.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -61.37 -36.88 81.46 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 121.268 0.556 . . . . 0.0 110.472 177.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.433 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -73.34 -44.74 58.26 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.05 179.443 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 29' ' ' VAL . 78.2 t -60.81 -43.21 94.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.403 -179.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -68.23 -34.61 76.55 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.686 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -72.78 -43.59 62.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.657 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.762 ' HB2' HG11 ' A' ' 70' ' ' VAL . 94.8 mt -68.47 -32.16 71.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.111 0.481 . . . . 0.0 111.327 -178.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.9 mt -86.4 7.05 27.28 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.433 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.605 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 9.5 t70 -81.59 134.8 35.54 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.4 p -56.64 -32.9 65.79 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.696 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -68.13 -43.07 79.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.133 0.492 . . . . 0.0 110.571 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.418 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.5 t -78.04 -24.14 13.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.072 -175.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.605 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 83.9 mtt180 -60.97 -21.8 63.86 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.906 0.384 . . . . 0.0 110.358 173.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -85.69 -18.79 32.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.261 -177.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 p -88.32 155.81 51.48 Favored Pre-proline 0 C--N 1.328 -0.369 0 O-C-N 122.439 -0.163 . . . . 0.0 111.155 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.42 156.32 65.86 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.757 2.304 . . . . 0.0 112.04 176.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.443 HG21 ' HE3' ' A' ' 74' ' ' LYS . 2.2 m -60.06 -40.17 88.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.476 -176.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.6 m -58.55 -38.39 77.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.015 -177.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.1 m -65.55 -45.17 84.41 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.629 177.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.567 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 82.1 mttt -57.34 -48.59 78.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.058 178.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.509 HG12 HD21 ' A' ' 83' ' ' LEU . 57.9 t -63.84 -46.02 95.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.191 -177.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 17.0 m170 -64.53 -39.5 93.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.81 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -66.2 -42.72 88.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.097 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 67.3 mt -63.69 -34.76 78.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.804 178.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.532 ' HD3' HD22 ' A' ' 83' ' ' LEU . 33.8 ttpt -61.09 -44.36 97.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.805 0.336 . . . . 0.0 110.222 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.4 p -72.41 -12.98 61.34 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.515 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -81.98 1.35 35.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.859 0.361 . . . . 0.0 110.936 176.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 93.98 14.43 52.03 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.364 178.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.465 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 5.9 mp -91.49 147.99 22.62 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.013 0.435 . . . . 0.0 111.589 179.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.423 ' O ' HG13 ' A' ' 63' ' ' ILE . 1.9 m -92.72 173.25 7.86 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.006 173.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.87 -36.01 76.0 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.712 0.292 . . . . 0.0 111.087 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.7 mp0 -66.43 -45.23 80.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.919 -179.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -62.88 -43.32 99.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.523 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.426 HG23 HD12 ' A' ' 53' ' ' LEU . 78.2 mt -63.08 -45.12 99.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.649 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.5 t -57.78 -45.2 86.33 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.213 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.692 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 33.4 tt0 -67.35 -47.64 69.85 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.602 -178.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.545 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.89 -45.38 82.59 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.137 -178.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.574 ' O ' HG22 ' A' ' 70' ' ' VAL . 2.7 m-85 -57.98 -42.23 84.64 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.193 178.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.1 m -67.16 -33.29 75.1 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.177 0.513 . . . . 0.0 110.416 -177.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.692 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 20.1 mtpp -72.39 -29.79 64.07 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.986 -179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.762 HG11 ' HB2' ' A' ' 36' ' ' LEU . 10.8 m -83.75 0.27 4.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.854 0.359 . . . . 0.0 111.534 -178.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 96.13 18.33 31.84 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.42 178.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -127.46 91.15 46.7 Favored Pre-proline 0 C--N 1.323 -0.587 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -73.72 93.78 0.86 Allowed 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 121.992 1.795 . . . . 0.0 112.817 -175.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.443 ' HE3' HG21 ' A' ' 46' ' ' THR . 74.2 mmtt -103.65 137.46 41.67 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.482 175.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.452 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 70.0 p -77.47 162.92 26.8 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.263 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 44.3 tp -62.53 -32.63 73.6 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.119 -0.696 . . . . 0.0 109.119 175.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -60.35 -46.32 90.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.818 176.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.452 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 36.7 mm-40 -59.57 -45.88 90.55 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.09 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.419 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 39.4 mm -60.21 -46.78 94.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.524 -177.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -64.39 -39.52 94.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.932 0.396 . . . . 0.0 110.659 177.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.9 tpp180 -60.18 -46.55 89.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.393 177.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.5 mt -67.93 -31.99 54.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.202 -178.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.532 HD22 ' HD3' ' A' ' 54' ' ' LYS . 91.8 mt -82.64 -4.03 57.13 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.741 0.305 . . . . 0.0 111.358 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 45.5 m . . . . . 0 C--O 1.252 1.208 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.614 177.513 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.4 pttt . . . . . 0 CA--C 1.531 0.229 0 CA-C-O 120.535 0.207 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.1 mtm-85 -70.47 -41.13 73.14 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 122.29 -0.256 . . . . 0.0 111.572 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.474 ' O ' HG23 ' A' ' 33' ' ' VAL . 75.2 t -66.01 -39.37 84.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 121.066 -0.253 . . . . 0.0 110.537 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.9 m -58.6 -40.59 83.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.71 0.29 . . . . 0.0 110.49 176.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.449 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 29.8 m-80 -66.55 -36.29 82.31 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.957 177.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.48 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -72.38 -45.22 60.76 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.441 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.58 HG13 HG12 ' A' ' 70' ' ' VAL . 78.2 t -61.36 -41.46 89.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.623 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 11.2 pt-20 -68.4 -33.64 74.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 0.0 110.658 178.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -71.88 -43.57 65.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.627 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.836 ' HB2' HG11 ' A' ' 70' ' ' VAL . 96.5 mt -67.75 -30.3 69.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.248 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.8 mt -85.82 4.24 38.01 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.018 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.549 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 18.4 t70 -75.04 132.81 41.58 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 177.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.5 m -53.66 -39.98 65.5 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 -174.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -69.17 -47.47 64.85 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.036 0.445 . . . . 0.0 110.327 178.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.3 t -66.65 -25.64 35.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.975 -177.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.549 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 83.0 mtp180 -65.52 -22.13 66.69 Favored 'General case' 0 C--N 1.319 -0.737 0 O-C-N 122.151 -0.343 . . . . 0.0 111.371 175.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 74.9 mtm180 -101.67 6.99 42.17 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -175.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.601 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -96.14 169.92 8.32 Favored Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 175.116 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.601 ' HD2' HG22 ' A' ' 44' ' ' THR . 57.2 Cg_endo -71.05 157.53 57.56 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.335 2.023 . . . . 0.0 111.906 175.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.478 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.3 OUTLIER -68.5 -39.83 81.12 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.524 -176.82 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.8 m -58.86 -35.8 73.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.521 -175.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.462 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 70.1 m -64.06 -44.82 91.29 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.221 0.534 . . . . 0.0 110.915 179.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.481 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 24.5 mttm -63.56 -45.47 90.37 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.502 -178.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 77.8 t -62.51 -44.62 99.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.57 -177.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 31.1 m170 -64.84 -38.24 90.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.401 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.491 ' O ' ' HG3' ' A' ' 56' ' ' LYS . 55.8 t80 -68.82 -43.37 75.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.725 -179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 76.8 mt -66.26 -38.7 88.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.756 0.312 . . . . 0.0 110.793 179.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -60.37 -40.6 91.42 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.242 0.544 . . . . 0.0 109.763 173.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.0 t -68.64 -20.03 64.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.244 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 52' ' ' PHE . 28.9 mtpp -81.5 -7.83 59.64 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.904 177.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.95 10.55 39.65 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.832 178.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.8 mp -82.31 145.13 30.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.276 0.56 . . . . 0.0 111.77 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.443 ' O ' HG13 ' A' ' 63' ' ' ILE . 8.6 m -85.42 164.82 17.66 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.123 175.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.33 -35.44 71.9 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.137 0.494 . . . . 0.0 110.404 178.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -62.79 -48.94 76.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.703 177.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -64.9 -44.49 89.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.242 -177.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 59' ' ' SER . 73.2 mt -59.77 -41.79 86.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.258 178.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.1 t -59.31 -44.52 92.55 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.609 178.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -68.3 -45.92 71.72 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.192 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.565 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.56 -45.32 81.31 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.515 -178.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.573 ' O ' HG22 ' A' ' 70' ' ' VAL . 7.6 m-85 -59.95 -45.05 93.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.107 0.479 . . . . 0.0 110.934 178.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.0 m -64.82 -33.13 75.26 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.622 -178.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.556 ' HE3' HG21 ' A' ' 33' ' ' VAL . 20.1 mtmt -71.77 -32.14 67.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.652 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.836 HG11 ' HB2' ' A' ' 36' ' ' LEU . 13.4 m -81.64 -3.83 7.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.714 0.292 . . . . 0.0 111.286 -177.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 100.01 18.21 22.97 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.298 179.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -126.6 90.94 48.59 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -73.63 97.18 0.95 Allowed 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 121.993 1.795 . . . . 0.0 112.748 -174.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.478 ' HE3' HG21 ' A' ' 46' ' ' THR . 74.3 mmtt -107.38 137.76 44.83 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.914 174.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.502 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 45.4 p -82.22 169.21 16.84 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.477 178.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.2 tp -62.9 -33.54 75.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.368 0.604 . . . . 0.0 109.811 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -60.27 -45.44 93.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.798 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.502 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 12.2 mm-40 -60.78 -47.15 87.63 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.052 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 42.6 mm -60.17 -46.15 94.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.805 -177.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 60.3 mttm -64.02 -40.06 95.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.363 . . . . 0.0 111.069 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -64.55 -43.61 93.4 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.74 178.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 72.7 mt -66.92 -31.73 54.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.618 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.9 mt -81.09 -6.85 59.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.482 177.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 14.4 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.433 -0.794 . . . . 0.0 109.746 177.175 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 120.585 0.231 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.572 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 82.7 mtm-85 -68.36 -44.23 75.68 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.862 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.57 ' O ' HG23 ' A' ' 33' ' ' VAL . 94.2 t -60.9 -41.94 90.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 110.027 -0.361 . . . . 0.0 110.027 177.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.0 t -60.64 -45.55 93.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.842 0.353 . . . . 0.0 110.404 178.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -62.86 -35.31 79.57 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.996 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.39 -44.73 64.4 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.152 179.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.578 HG13 HG12 ' A' ' 70' ' ' VAL . 87.4 t -60.98 -42.69 93.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.56 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -68.65 -35.18 76.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.839 179.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -71.76 -43.25 66.09 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-O 120.925 0.393 . . . . 0.0 110.791 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.762 ' HB2' HG11 ' A' ' 70' ' ' VAL . 87.1 mt -65.24 -30.68 71.58 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.329 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.449 ' HA ' HD23 ' A' ' 37' ' ' LEU . 13.0 mt -85.72 7.47 23.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.979 -178.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.48 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 13.5 t70 -78.99 138.06 37.87 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 176.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.0 m -57.09 -39.63 75.39 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -176.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -68.22 -37.09 80.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.059 0.457 . . . . 0.0 110.412 -179.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.552 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 70.7 t -75.13 -34.01 30.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.758 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.48 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 84.0 mtp180 -63.84 -21.14 66.3 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.03 0.443 . . . . 0.0 110.303 174.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -88.52 -17.49 30.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.026 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.5 p -85.52 159.7 55.18 Favored Pre-proline 0 C--N 1.329 -0.309 0 O-C-N 122.195 -0.316 . . . . 0.0 110.848 177.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.25 158.9 49.81 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.625 2.217 . . . . 0.0 112.021 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.472 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.3 OUTLIER -61.77 -39.6 92.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.541 -176.052 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.43 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 7.6 t -59.38 -43.1 92.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.765 -176.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.3 m -60.33 -42.89 96.57 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.021 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.552 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 79.9 mttt -60.26 -49.1 78.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.001 178.036 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.476 HG12 HD21 ' A' ' 83' ' ' LEU . 59.2 t -65.59 -44.26 93.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.809 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 22.5 m170 -63.9 -37.41 87.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.013 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -66.89 -44.36 81.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.463 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 89.0 mt -66.5 -41.15 89.31 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.887 -178.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.459 ' HD2' ' O ' ' A' ' 58' ' ' LEU . 42.4 tptt -62.84 -37.33 86.4 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.181 0.515 . . . . 0.0 109.926 176.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 35.5 t -70.98 -14.24 62.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.821 178.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 37.4 mtpt -91.46 2.1 56.66 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.998 0.428 . . . . 0.0 110.933 176.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.91 6.12 57.18 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.59 -0.814 . . . . 0.0 113.026 176.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.572 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.4 mp -73.19 153.0 40.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.201 0.524 . . . . 0.0 111.283 178.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.2 m -92.89 161.86 14.31 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.336 172.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.13 -42.61 86.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.798 0.332 . . . . 0.0 111.147 -177.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -62.16 -38.32 88.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.03 178.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.85 -41.98 86.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.048 0.451 . . . . 0.0 110.384 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.434 HG21 HG13 ' A' ' 50' ' ' VAL . 71.8 mt -63.6 -45.2 98.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.402 176.21 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 45.2 t -56.8 -42.6 79.79 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.016 178.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 57.3 tt0 -66.35 -48.42 70.28 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.659 178.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.521 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.72 -47.91 78.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.093 -178.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.617 ' O ' HG22 ' A' ' 70' ' ' VAL . 5.2 m-85 -55.29 -46.83 76.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.022 0.439 . . . . 0.0 111.308 178.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.4 m -65.48 -32.63 74.34 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.961 0.41 . . . . 0.0 110.697 -177.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.5 ' HE3' HG21 ' A' ' 33' ' ' VAL . 21.8 mtmt -72.12 -28.88 63.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.769 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.762 HG11 ' HB2' ' A' ' 36' ' ' LEU . 10.6 m -84.18 -1.21 6.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.08 0.467 . . . . 0.0 111.193 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.09 14.05 43.72 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.449 178.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -121.22 90.6 47.57 Favored Pre-proline 0 C--N 1.322 -0.615 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -70.87 105.2 1.62 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.012 1.808 . . . . 0.0 112.167 -175.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -116.35 138.39 51.37 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.791 176.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.1 p -82.03 159.28 23.51 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.34 179.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 55.4 tp -61.7 -32.85 73.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.287 0.565 . . . . 0.0 109.661 177.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -57.01 -46.38 82.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.018 177.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.428 ' O ' HG13 ' A' ' 82' ' ' ILE . 38.3 mt-10 -63.33 -46.94 84.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.527 179.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 46.9 mm -59.93 -44.39 94.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.919 -176.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -63.77 -43.09 97.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.058 0.456 . . . . 0.0 110.773 178.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -63.33 -44.72 94.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.979 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.43 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 96.4 mt -63.84 -36.64 77.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.101 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.476 HD21 HG12 ' A' ' 50' ' ' VAL . 75.5 mt -77.53 -25.39 50.19 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.289 -179.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 7.1 t . . . . . 0 C--O 1.254 1.3 0 CA-C-O 118.181 -0.914 . . . . 0.0 109.996 -179.107 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.445 0.164 . . . . 0.0 111.015 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.516 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 88.4 mtm-85 -69.46 -39.55 77.67 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.908 0.385 . . . . 0.0 110.204 177.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.643 ' O ' HG23 ' A' ' 33' ' ' VAL . 71.2 t -62.75 -43.57 98.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.109 174.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 45.3 m -58.0 -45.86 86.16 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.749 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -61.66 -37.64 84.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.092 0.472 . . . . 0.0 110.928 178.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.49 -44.38 62.34 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.46 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.643 HG23 ' O ' ' A' ' 29' ' ' VAL . 67.7 t -61.07 -43.3 95.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.023 0.44 . . . . 0.0 110.355 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -69.22 -35.96 76.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.794 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -72.32 -43.48 64.09 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.834 0.35 . . . . 0.0 110.994 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.619 ' HB2' HG11 ' A' ' 70' ' ' VAL . 75.0 mt -63.61 -31.1 72.16 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.491 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 37' ' ' LEU . 11.7 mt -85.89 6.99 25.83 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -178.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -77.07 139.38 39.99 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.717 -0.393 . . . . 0.0 109.989 177.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.564 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 14.5 m -57.89 -37.04 73.26 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.933 -175.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 33.4 mmt180 -69.57 -38.5 77.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.155 0.502 . . . . 0.0 110.587 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.582 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 58.2 t -74.5 -34.52 35.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.132 -176.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' ' 39' ' ' SER . 22.4 ptt180 -67.63 -21.37 65.39 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.877 0.37 . . . . 0.0 110.254 176.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -89.28 -7.11 56.1 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.686 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.4 p -96.96 158.4 33.46 Favored Pre-proline 0 C--N 1.326 -0.451 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.012 176.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -62.46 154.88 61.31 Favored 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.703 2.268 . . . . 0.0 111.95 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.446 ' O ' HG23 ' A' ' 50' ' ' VAL . 1.3 m -60.27 -35.63 75.96 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.859 -178.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.3 m -58.24 -42.87 87.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.786 -178.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.2 m -63.25 -45.74 90.15 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.873 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.582 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 82.2 mttt -57.46 -49.99 74.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.179 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 46' ' ' THR . 80.9 t -64.23 -43.54 97.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.925 -176.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 26.2 m170 -64.56 -37.48 87.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.081 -178.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -69.68 -42.68 73.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.387 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 68.7 mt -64.46 -39.26 93.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.674 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.44 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 29.8 tptt -63.87 -39.93 95.36 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 120.967 0.413 . . . . 0.0 110.102 176.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.2 t -69.63 -14.35 62.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.713 178.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -83.86 -1.61 54.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.793 176.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.42 17.92 47.72 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.627 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.516 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.4 mp -83.03 159.0 22.27 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.265 0.555 . . . . 0.0 111.043 177.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.1 m -100.59 165.23 11.51 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.438 -0.801 . . . . 0.0 108.897 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.95 -34.51 69.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.906 0.384 . . . . 0.0 110.821 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.97 -49.62 76.95 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.905 177.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -63.67 -43.64 96.12 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.902 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 78.5 mt -60.84 -44.96 98.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.715 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.6 t -60.81 -43.39 98.25 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.7 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.417 ' OE1' HG21 ' A' ' 29' ' ' VAL . 27.5 tt0 -68.85 -48.54 63.22 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.123 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.79 -41.57 82.39 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 120.726 0.298 . . . . 0.0 111.551 -178.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.403 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.1 m-85 -60.93 -45.43 94.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.578 176.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 20.8 m -64.85 -34.33 78.11 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.043 0.449 . . . . 0.0 110.292 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.0 mmmt -63.14 -32.5 73.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.962 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.619 HG11 ' HB2' ' A' ' 36' ' ' LEU . 24.1 m -91.95 8.1 4.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.97 0.414 . . . . 0.0 111.401 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.41 23.7 33.34 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.794 177.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -126.61 91.31 47.71 Favored Pre-proline 0 C--N 1.32 -0.682 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 176.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -72.09 102.92 1.41 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 121.899 1.732 . . . . 0.0 111.744 -178.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -108.93 139.35 43.91 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.657 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 38.1 p -80.49 156.64 26.45 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.183 178.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 38.9 tp -63.25 -32.69 74.16 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.126 0.488 . . . . 0.0 109.943 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -60.36 -45.17 94.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.723 177.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -59.04 -47.58 84.72 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.511 177.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.0 mm -59.8 -45.19 95.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.433 -178.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.2 -44.99 93.79 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.868 0.366 . . . . 0.0 110.874 177.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.3 tpp180 -61.65 -47.22 86.38 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.943 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 86.3 mt -64.6 -34.45 69.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.765 -179.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 80.8 mt -81.61 -4.3 55.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.794 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 38.4 m . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.836 -0.602 . . . . 0.0 110.282 176.004 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt . . . . . 0 N--CA 1.456 -0.151 0 CA-C-O 120.514 0.197 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 51.6 mtm-85 -69.74 -40.23 76.3 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.52 0.2 . . . . 0.0 111.138 -177.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.652 ' O ' HG23 ' A' ' 33' ' ' VAL . 81.6 t -60.57 -43.7 95.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 175.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.3 m -62.16 -38.23 88.25 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.198 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.44 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 95.1 m-20 -61.79 -37.13 83.21 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.25 0.547 . . . . 0.0 110.382 177.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.05 -44.92 52.54 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.211 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.652 HG23 ' O ' ' A' ' 29' ' ' VAL . 61.8 t -61.58 -39.94 84.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.832 0.349 . . . . 0.0 110.544 -178.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 12.7 pt-20 -68.72 -38.46 80.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.91 178.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -72.38 -43.28 64.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.821 0.343 . . . . 0.0 110.935 -179.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.665 ' HB2' HG11 ' A' ' 70' ' ' VAL . 88.7 mt -66.15 -31.15 71.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.595 -177.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.518 ' HG ' HG12 ' A' ' 70' ' ' VAL . 11.3 mt -86.03 4.62 37.12 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -177.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.552 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 12.4 t70 -75.46 138.18 41.45 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.233 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.2 t -53.95 -37.71 64.17 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.389 -178.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 73.2 mtm180 -68.54 -46.52 69.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.393 0.616 . . . . 0.0 110.414 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.444 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.2 t -71.41 -29.46 35.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.209 -174.04 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.552 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 78.6 mtp180 -65.38 -21.96 66.74 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.213 177.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 25.2 mtm180 -90.12 -17.09 28.3 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.646 0.239 . . . . 0.0 111.646 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.3 p -83.64 159.17 61.59 Favored Pre-proline 0 C--N 1.326 -0.42 0 C-N-CA 121.238 -0.185 . . . . 0.0 110.89 177.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.45 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 35.8 Cg_endo -65.09 159.45 46.63 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.659 2.24 . . . . 0.0 112.512 177.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.415 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.7 OUTLIER -61.76 -39.73 92.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.22 -177.749 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 5.9 m -58.26 -40.96 83.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.278 -177.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 63.7 m -62.97 -46.64 86.76 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.736 177.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.542 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 80.7 mttt -56.99 -49.01 77.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.313 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 46' ' ' THR . 91.2 t -64.2 -45.02 97.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.268 -176.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 17.8 m170 -64.84 -38.93 92.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.017 -178.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -64.14 -42.93 96.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.277 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 87.7 mt -65.71 -37.97 87.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.848 -179.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -60.84 -42.24 97.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.005 174.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.4 t -69.59 -13.67 62.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.631 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.8 mmpt? -85.6 -3.04 58.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.626 175.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.1 17.37 40.68 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.637 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.2 mp -88.38 152.53 21.85 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.397 0.618 . . . . 0.0 111.934 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.2 m -93.52 164.91 13.0 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.743 175.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.23 -37.46 74.9 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.897 0.379 . . . . 0.0 110.839 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.443 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 1.6 mp0 -62.44 -46.87 86.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.42 178.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -65.63 -40.5 92.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.621 -177.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.4 HG23 HD12 ' A' ' 53' ' ' LEU . 87.8 mt -64.64 -45.8 94.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.608 177.124 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 31.3 t -56.68 -44.76 81.78 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.165 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -68.27 -45.86 71.97 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.066 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 69' ' ' LYS . . . -57.76 -40.76 80.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.737 0.303 . . . . 0.0 111.473 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.416 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.2 m-85 -60.04 -45.41 92.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.654 176.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.3 m -65.32 -33.08 75.13 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.229 0.538 . . . . 0.0 109.803 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 66' ' ' ALA . 27.0 mmmt -62.06 -35.77 79.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.937 177.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.665 HG11 ' HB2' ' A' ' 36' ' ' LEU . 22.1 m -89.89 5.37 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.822 0.344 . . . . 0.0 111.577 -176.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 94.66 13.5 53.31 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.875 176.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -119.42 90.81 43.21 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -72.43 102.31 1.37 Allowed 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 121.849 1.699 . . . . 0.0 112.053 -178.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -111.21 138.42 47.67 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.837 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 32.9 p -76.74 158.9 30.61 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.516 178.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 49.5 tp -62.99 -32.96 74.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.146 0.498 . . . . 0.0 109.947 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -58.72 -45.29 89.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.758 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.2 mm-40 -59.14 -48.76 80.43 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.521 178.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.7 mm -60.51 -44.19 95.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.678 -177.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -63.14 -44.04 96.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.932 177.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -60.99 -43.0 99.47 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.109 178.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 77.0 mt -66.68 -36.58 77.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.942 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 83.6 mt -77.74 -24.66 48.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.403 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 51.8 p . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.613 -0.708 . . . . 0.0 110.317 179.378 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.1 pttt . . . . . 0 N--CA 1.457 -0.091 0 CA-C-O 120.319 0.104 . . . . 0.0 110.9 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.472 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 29.0 mtm180 -62.52 -47.36 84.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.799 0.333 . . . . 0.0 110.379 178.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.516 ' O ' HG23 ' A' ' 33' ' ' VAL . 75.6 t -65.0 -39.89 87.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.075 177.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.0 m -58.04 -46.57 85.13 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.775 177.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -63.02 -36.47 83.68 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.172 178.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.405 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -71.68 -44.92 63.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.05 -179.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.516 HG23 ' O ' ' A' ' 29' ' ' VAL . 82.2 t -61.18 -43.13 95.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.55 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -68.36 -35.53 77.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.9 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -72.43 -43.76 63.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.813 0.34 . . . . 0.0 110.677 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.68 ' HB2' HG11 ' A' ' 70' ' ' VAL . 86.6 mt -64.8 -29.95 70.94 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.563 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 37' ' ' LEU . 19.6 mt -85.04 7.69 20.54 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.088 -176.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.658 ' OD2' ' HG2' ' A' ' 40' ' ' ARG . 9.4 t70 -85.37 139.06 31.86 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.104 177.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.649 ' O ' ' HG3' ' A' ' 43' ' ' ARG . 27.1 t -55.52 -41.15 72.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.238 -178.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.658 ' HG2' ' OD2' ' A' ' 38' ' ' ASP . 11.0 ptm180 -67.81 -32.56 73.21 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.035 0.445 . . . . 0.0 110.646 -177.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.567 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 98.8 t -78.98 -33.18 15.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.444 -178.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 82.7 mtp180 -66.56 -22.04 66.15 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.909 175.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.649 ' HG3' ' O ' ' A' ' 39' ' ' SER . 67.9 mtt180 -86.15 -18.32 32.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.464 -178.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.08 158.73 58.15 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 121.187 -0.205 . . . . 0.0 110.822 177.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.37 154.02 73.66 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.381 2.054 . . . . 0.0 112.015 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -34.43 73.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.952 -177.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.6 p -58.54 -43.1 89.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.843 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 62.0 m -64.78 -44.67 89.24 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.124 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.567 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 82.9 mttt -56.98 -49.38 75.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.078 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 62.3 t -67.73 -43.62 86.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.009 -176.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 25.2 m170 -65.04 -36.68 85.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.595 -177.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.45 ' O ' ' HG3' ' A' ' 56' ' ' LYS . 72.6 t80 -69.94 -45.45 67.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.45 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 98.9 mt -62.87 -40.84 98.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.075 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.423 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 46.5 tptt -62.96 -40.0 96.36 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.427 177.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.3 t -70.79 -13.78 62.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.637 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' A' ' 52' ' ' PHE . 39.4 mtpt -86.12 -2.8 58.67 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.189 177.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 102.04 9.22 42.98 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.886 177.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.472 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.9 mp -80.6 156.01 26.62 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.44 0.638 . . . . 0.0 111.62 178.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.422 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 20.1 m -98.71 168.89 9.86 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.538 174.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.18 95.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.686 0.279 . . . . 0.0 111.113 -177.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -60.53 -40.85 93.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.938 177.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.422 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 6.3 mm-40 -63.1 -47.97 80.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.961 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 61.9 mt -64.65 -45.41 95.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.72 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.6 t -56.98 -45.02 83.25 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.946 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -67.76 -47.02 70.42 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.909 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.552 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -57.19 -47.26 81.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.052 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.578 ' O ' HG22 ' A' ' 70' ' ' VAL . 2.7 m-85 -56.44 -44.23 80.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.105 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.1 m -66.15 -33.54 76.01 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.807 0.337 . . . . 0.0 110.65 -177.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.492 ' HE3' HG21 ' A' ' 33' ' ' VAL . 22.4 mtmt -70.91 -30.95 67.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.795 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.68 HG11 ' HB2' ' A' ' 36' ' ' LEU . 7.9 m -83.47 -0.83 5.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.848 0.356 . . . . 0.0 111.287 -177.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 96.28 19.87 26.91 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.483 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -127.81 91.3 45.57 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 177.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.84 101.14 1.15 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 121.892 1.728 . . . . 0.0 112.57 -175.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -109.46 139.35 44.55 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.044 176.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 34.7 p -82.45 164.55 20.89 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.113 176.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.1 tp -63.08 -32.73 74.18 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 176.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -59.52 -45.62 91.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.475 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -58.69 -46.94 86.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.216 178.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 41.6 mm -61.59 -45.36 98.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.786 -177.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -64.14 -39.53 94.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.998 0.428 . . . . 0.0 110.479 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -59.89 -48.63 80.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.898 177.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.3 mt -69.85 -33.37 55.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.828 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 75.5 mt -82.97 1.64 38.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.745 0.307 . . . . 0.0 111.598 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 26.2 t . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.577 -0.725 . . . . 0.0 109.264 176.026 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.6 pttt . . . . . 0 N--CA 1.455 -0.214 0 N-CA-C 110.387 -0.227 . . . . 0.0 110.387 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.493 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 21.2 mtm180 -65.46 -45.52 83.42 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.645 ' O ' HG23 ' A' ' 33' ' ' VAL . 73.3 t -60.63 -46.39 95.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.843 175.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.1 t -59.68 -42.83 93.82 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.171 -179.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -61.83 -36.85 82.39 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.051 0.453 . . . . 0.0 110.632 177.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.447 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -72.28 -41.86 66.21 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.878 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 29' ' ' VAL . 93.6 t -61.0 -46.55 96.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 120.869 0.366 . . . . 0.0 110.246 179.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -68.75 -33.65 74.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.815 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -71.42 -43.59 66.48 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.056 0.455 . . . . 0.0 110.615 179.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.635 ' HB2' HG11 ' A' ' 70' ' ' VAL . 93.2 mt -66.81 -32.24 73.4 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.884 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.2 mt -88.69 6.31 39.09 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -77.24 138.18 39.26 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.519 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 48.7 m -59.81 -33.93 72.39 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 -176.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.529 ' HG2' HG23 ' A' ' 41' ' ' VAL . 7.5 ptp180 -70.63 -40.58 73.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.069 0.461 . . . . 0.0 110.142 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.529 HG23 ' HG2' ' A' ' 40' ' ' ARG . 47.6 t -80.32 -26.96 11.7 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.856 -173.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.519 ' HG2' ' O ' ' A' ' 39' ' ' SER . 37.5 ptt180 -64.37 -20.29 66.03 Favored 'General case' 0 C--N 1.318 -0.799 0 O-C-N 121.738 -0.601 . . . . 0.0 111.222 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -83.43 -17.77 40.99 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -176.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.519 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -85.98 169.84 14.46 Favored Pre-proline 0 CA--C 1.536 0.442 0 O-C-N 122.44 -0.163 . . . . 0.0 111.348 -176.118 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.519 ' HD2' HG22 ' A' ' 44' ' ' THR . 44.2 Cg_endo -69.14 162.88 39.94 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.467 2.111 . . . . 0.0 112.191 174.455 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.46 -45.01 73.59 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.834 -176.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.1 m -58.44 -38.01 76.6 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.95 -174.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.8 m -60.27 -42.86 96.3 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 121.114 0.483 . . . . 0.0 110.873 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.493 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 25.3 mttm -63.71 -45.0 91.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.516 -178.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 60.3 t -63.17 -43.25 98.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.653 -178.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -64.59 -37.62 88.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.658 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -67.27 -46.27 74.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.531 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 96.2 mt -61.86 -39.62 92.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.746 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 51.1 tptt -59.87 -42.81 94.53 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.518 175.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.0 t -70.97 -19.32 62.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.841 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 55.3 mmtt -82.04 -3.56 54.86 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.989 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 102.14 9.0 43.29 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.566 -0.826 . . . . 0.0 112.824 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.493 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.4 mp -82.55 149.36 27.54 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.381 0.61 . . . . 0.0 111.315 179.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.417 ' H ' ' HG3' ' A' ' 62' ' ' GLU . 39.6 m -94.18 169.58 10.14 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.559 174.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.1 -37.78 77.96 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.861 0.363 . . . . 0.0 110.875 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.21 -44.85 92.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.401 177.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.421 ' H ' ' HG2' ' A' ' 62' ' ' GLU . 4.5 mm-40 -63.17 -48.29 79.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.877 -178.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 61.3 mt -63.38 -43.54 98.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.946 -178.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 52.6 t -57.51 -44.1 84.75 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.848 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -68.57 -48.46 64.17 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.905 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.18 -41.11 78.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.883 -178.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.424 ' O ' HG22 ' A' ' 70' ' ' VAL . 6.6 m-85 -61.26 -45.9 92.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.849 0.357 . . . . 0.0 110.635 177.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.5 m -63.08 -35.35 79.95 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.105 0.479 . . . . 0.0 110.125 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.409 ' HB2' HG22 ' A' ' 33' ' ' VAL . 29.0 mmtt -60.93 -36.46 79.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.45 178.344 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.635 HG11 ' HB2' ' A' ' 36' ' ' LEU . 18.6 m -90.6 9.59 3.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.543 -175.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.62 16.07 57.32 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.799 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.404 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 6.5 tp-100 -121.75 90.64 48.39 Favored Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 177.344 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.07 95.86 0.85 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 121.955 1.77 . . . . 0.0 112.588 -176.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -103.63 137.72 41.29 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.678 175.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 41.7 p -77.68 161.72 27.56 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.136 177.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.454 ' HG ' ' HE3' ' A' ' 80' ' ' LYS . 62.6 tp -61.65 -32.94 73.13 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -60.34 -44.25 95.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.997 176.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -57.45 -49.13 77.25 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.088 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 41.1 mm -60.77 -41.83 89.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.449 -177.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.454 ' HE3' ' HG ' ' A' ' 76' ' ' LEU . 96.1 mttt -61.18 -44.08 97.87 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.151 177.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.0 tpp180 -62.58 -46.14 89.7 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.598 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 83.9 mt -65.3 -36.56 78.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.131 -178.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 72.2 mt -80.91 -4.57 55.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.617 0.246 . . . . 0.0 111.638 178.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 19.9 t . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.732 -0.652 . . . . 0.0 109.629 178.033 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt . . . . . 0 N--CA 1.456 -0.15 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.408 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 21.2 mtm180 -70.04 -41.55 74.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.344 178.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.464 ' O ' HG23 ' A' ' 33' ' ' VAL . 69.3 t -61.1 -44.52 98.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.09 174.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.3 m -60.84 -43.29 98.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.837 178.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -61.75 -35.84 79.28 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.068 0.461 . . . . 0.0 110.681 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.48 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -72.07 -44.8 62.74 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.953 178.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.564 HG13 HG12 ' A' ' 70' ' ' VAL . 67.7 t -60.98 -43.42 96.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.684 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -67.88 -35.9 79.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.67 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -72.26 -43.7 63.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.902 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.688 ' HB2' HG11 ' A' ' 70' ' ' VAL . 93.1 mt -65.12 -31.35 72.5 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.453 -178.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.402 ' HA ' HD23 ' A' ' 37' ' ' LEU . 11.8 mt -85.79 -0.68 55.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.222 -0.444 . . . . 0.0 112.086 -176.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -69.26 138.18 53.71 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.402 ' HA ' ' HG2' ' A' ' 42' ' ' ARG . 11.8 m -63.05 -30.5 71.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.843 0.354 . . . . 0.0 111.526 -175.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -69.34 -38.3 78.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.365 0.603 . . . . 0.0 110.39 175.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.7 t -79.24 -36.35 18.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.251 -172.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.402 ' HG2' ' HA ' ' A' ' 39' ' ' SER . 17.2 ptp180 -62.13 -20.28 63.91 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 120.859 0.361 . . . . 0.0 110.796 176.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 43' ' ' ARG . 40.7 ttm180 -85.21 -18.92 32.59 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.586 -178.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.602 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -89.13 168.38 15.54 Favored Pre-proline 0 CA--C 1.536 0.405 0 CA-C-N 116.85 -0.159 . . . . 0.0 110.989 -177.657 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.602 ' HD2' HG22 ' A' ' 44' ' ' THR . 49.2 Cg_endo -68.18 156.88 64.13 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.695 2.264 . . . . 0.0 111.975 176.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.451 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -68.12 -33.97 75.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.065 -177.491 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.531 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 20.6 m -58.28 -40.75 82.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.518 -177.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 54.7 m -59.84 -48.02 83.36 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.089 178.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.483 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 2.2 mttp -58.17 -48.8 79.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.21 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 58.3 t -64.02 -41.58 92.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.747 -175.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -65.12 -39.28 92.85 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.368 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -65.18 -48.81 72.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.48 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 85.0 mt -62.68 -39.56 94.32 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.045 -177.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -60.51 -42.83 97.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.021 0.439 . . . . 0.0 110.236 175.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 45.7 m -68.77 -19.71 64.32 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.827 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -80.83 -8.22 59.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.732 176.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.52 8.32 37.99 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.826 177.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.408 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 5.5 mp -80.07 144.72 32.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.252 0.549 . . . . 0.0 111.842 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.425 ' O ' HG13 ' A' ' 63' ' ' ILE . 6.1 m -86.46 165.42 16.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.37 174.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.25 -38.8 84.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.994 0.426 . . . . 0.0 110.929 -178.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -65.49 -37.55 87.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.909 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -67.1 -48.05 69.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.54 177.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.429 HG23 HD12 ' A' ' 53' ' ' LEU . 73.7 mt -59.31 -44.89 93.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.537 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.4 t -56.61 -43.35 80.07 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.788 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.704 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 32.5 tt0 -67.93 -48.31 66.3 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.925 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.484 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.25 -43.77 79.02 Favored 'General case' 0 CA--C 1.519 -0.24 0 O-C-N 123.147 0.279 . . . . 0.0 110.965 -178.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.562 ' O ' HG22 ' A' ' 70' ' ' VAL . 7.0 m-85 -58.57 -43.88 89.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.944 0.402 . . . . 0.0 110.954 177.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.8 m -65.96 -33.13 75.11 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.112 0.482 . . . . 0.0 110.618 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.704 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 25.2 mtpp -72.33 -30.35 64.68 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.91 -179.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.688 HG11 ' HB2' ' A' ' 36' ' ' LEU . 14.4 m -84.2 1.66 4.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.939 0.4 . . . . 0.0 111.201 -179.132 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.07 12.88 47.94 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.561 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -121.53 90.72 48.12 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.73 103.48 1.46 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 121.776 1.65 . . . . 0.0 112.001 -176.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.451 ' HE3' HG21 ' A' ' 46' ' ' THR . 71.3 mmtt -111.87 138.28 48.69 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.004 177.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 50.9 p -80.09 167.8 19.95 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.047 176.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.4 tp -63.56 -32.66 74.19 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -59.22 -45.46 91.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.832 176.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -56.31 -49.08 75.33 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.33 179.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 39.7 mm -63.45 -48.8 85.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.835 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -64.37 -39.63 94.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.41 -178.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -64.97 -44.69 88.54 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.116 0.484 . . . . 0.0 110.634 178.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.531 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 97.4 mt -65.48 -32.49 58.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.985 178.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 71.2 mt -79.36 -8.79 59.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.19 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 15.3 t . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.491 -0.766 . . . . 0.0 109.566 178.513 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.7 pttt . . . . . 0 CA--C 1.529 0.147 0 CA-C-O 120.433 0.159 . . . . 0.0 110.621 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.476 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 53.2 mtm180 -65.47 -48.0 74.17 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.705 0.288 . . . . 0.0 110.482 177.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.533 ' O ' HG23 ' A' ' 33' ' ' VAL . 76.5 t -61.74 -42.96 96.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.171 177.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.7 m -58.89 -45.66 89.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.908 178.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -62.0 -36.86 82.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.995 0.426 . . . . 0.0 111.135 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.75 -45.37 61.92 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.969 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 29' ' ' VAL . 90.6 t -61.22 -42.75 94.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.616 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.42 -35.82 76.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.168 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -71.21 -43.23 67.76 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.948 0.404 . . . . 0.0 110.553 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.721 ' HB2' HG11 ' A' ' 70' ' ' VAL . 88.9 mt -65.34 -29.19 69.89 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.284 179.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 37' ' ' LEU . 13.8 mt -85.67 6.35 27.98 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.693 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 13.4 t70 -79.72 133.56 36.35 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.661 -0.415 . . . . 0.0 109.939 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.5 m -52.96 -38.96 62.58 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 123.495 0.497 . . . . 0.0 112.044 -175.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -69.61 -36.68 76.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.128 0.49 . . . . 0.0 110.742 -179.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.526 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 61.5 t -76.8 -21.81 14.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.464 0.649 . . . . 0.0 110.385 -178.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.693 ' HG2' ' O ' ' A' ' 38' ' ' ASP . 20.4 mmm180 -64.08 -25.81 68.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.256 173.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -91.64 -17.98 24.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.542 -173.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.4 p -82.71 158.41 65.49 Favored Pre-proline 0 C--N 1.326 -0.447 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.123 -177.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -65.5 153.96 75.84 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.444 2.096 . . . . 0.0 111.754 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.57 -37.62 78.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.196 -177.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.513 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 18.9 m -58.76 -41.3 86.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.379 -177.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.6 m -63.57 -44.6 93.63 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.851 178.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.526 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 81.5 mttt -58.12 -48.26 80.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.398 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.451 HG12 HD21 ' A' ' 83' ' ' LEU . 85.2 t -66.96 -45.08 88.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.427 -176.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -64.38 -35.81 82.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.784 -177.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -67.14 -46.1 75.12 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.389 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 94.7 mt -64.25 -37.88 89.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.784 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.62 ' HD3' HD22 ' A' ' 83' ' ' LEU . 29.6 ttpt -63.26 -39.31 94.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.02 0.438 . . . . 0.0 109.94 176.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 44.3 m -68.71 -15.77 63.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.91 179.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -85.24 -4.08 59.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.613 175.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.09 1.68 55.94 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.854 -0.688 . . . . 0.0 112.694 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.476 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.4 mp -71.67 148.55 46.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.099 0.476 . . . . 0.0 111.364 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.464 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 9.4 m -90.79 165.98 13.36 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.286 175.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.86 -39.55 78.04 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.677 0.275 . . . . 0.0 111.683 -177.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -67.76 -35.07 78.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.39 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.464 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 4.1 mm-40 -64.96 -45.2 86.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.473 0.654 . . . . 0.0 109.48 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 67.8 mt -62.81 -42.1 95.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.291 177.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 32.1 t -56.8 -46.64 81.46 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.343 177.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -67.67 -48.13 67.5 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.712 -178.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.546 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.81 -45.76 82.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.295 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.549 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.1 m-85 -57.49 -45.1 85.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.898 0.38 . . . . 0.0 111.241 178.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.3 m -65.14 -33.23 75.52 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.94 0.4 . . . . 0.0 110.431 -177.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.514 ' HE3' HG21 ' A' ' 33' ' ' VAL . 21.3 mtmt -72.1 -27.73 62.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.607 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.721 HG11 ' HB2' ' A' ' 36' ' ' LEU . 8.4 m -88.79 7.49 3.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.736 0.303 . . . . 0.0 111.657 -179.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 93.05 17.21 44.48 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.743 176.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -127.22 91.08 47.38 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -68.19 105.72 1.25 Allowed 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 122.006 1.804 . . . . 0.0 112.195 -176.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -116.41 139.12 50.77 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.836 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 21.6 p -87.46 167.59 13.85 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.302 176.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 51.6 tp -63.63 -33.35 75.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.19 0.519 . . . . 0.0 109.676 176.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -57.77 -45.73 85.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.692 177.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -57.73 -48.36 79.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.994 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 36.5 mm -63.72 -46.02 95.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.813 -175.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -60.96 -43.05 99.31 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.07 0.462 . . . . 0.0 110.298 177.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.5 tpp180 -60.05 -45.12 93.89 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.434 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.513 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 86.9 mt -67.39 -35.07 72.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.964 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.62 HD22 ' HD3' ' A' ' 54' ' ' LYS . 84.3 mt -82.1 -0.18 43.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.382 179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 50.7 m . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.581 -0.723 . . . . 0.0 110.131 175.71 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt . . . . . 0 CA--C 1.523 -0.088 0 CA-C-O 120.527 0.203 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.579 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 60.2 mtm180 -63.84 -45.36 89.86 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.704 0.287 . . . . 0.0 110.626 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.487 ' O ' HG23 ' A' ' 33' ' ' VAL . 85.0 t -64.31 -41.44 92.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.415 177.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.4 m -62.08 -42.98 99.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.247 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -61.91 -35.65 79.0 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.172 0.51 . . . . 0.0 110.652 176.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.35 -44.91 61.93 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.243 179.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.493 HG13 HG12 ' A' ' 70' ' ' VAL . 71.5 t -60.87 -43.23 95.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.861 0.362 . . . . 0.0 110.527 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -68.31 -36.0 78.67 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.728 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 92.9 t80 -72.09 -44.17 63.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.841 0.353 . . . . 0.0 110.634 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.673 ' HB2' HG11 ' A' ' 70' ' ' VAL . 86.3 mt -62.74 -31.16 72.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.491 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 37' ' ' LEU . 14.0 mt -85.95 3.16 43.3 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -176.336 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.608 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 13.5 t70 -78.99 138.17 37.93 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.061 178.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.7 m -57.21 -38.07 73.17 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -176.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.5 ptp180 -68.6 -32.81 72.96 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.544 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 66.6 t -79.43 -31.16 14.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.261 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.608 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 86.9 mtt180 -61.82 -26.72 68.29 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.224 0.535 . . . . 0.0 109.646 173.048 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.445 ' HA ' ' NE ' ' A' ' 43' ' ' ARG . 6.8 tpm_? -85.71 -19.21 31.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.515 -178.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.1 p -82.6 155.18 68.67 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 122.057 -0.402 . . . . 0.0 110.688 178.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.421 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 35.3 Cg_endo -66.63 157.13 62.4 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.444 2.096 . . . . 0.0 111.777 175.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.413 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -59.65 -34.98 73.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.88 -178.076 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.7 p -58.58 -43.5 89.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.229 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 71.1 m -65.24 -44.37 88.42 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.846 179.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.554 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 81.3 mttt -57.35 -49.64 75.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.123 -179.239 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 46' ' ' THR . 64.7 t -66.22 -42.52 91.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.005 -176.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 24.9 m170 -64.73 -42.63 95.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.159 -178.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -66.12 -41.74 90.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.412 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 81.2 mt -63.05 -40.68 98.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.869 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.402 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 49.5 tptt -60.92 -40.84 94.73 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.103 0.478 . . . . 0.0 110.015 175.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.0 t -67.46 -20.08 65.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.907 178.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -81.11 5.76 15.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.232 178.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.04 12.62 58.72 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.58 177.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.579 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.5 mp -83.34 170.11 14.92 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.523 0.678 . . . . 0.0 111.804 179.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.442 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 16.8 m -117.71 164.28 15.22 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.78 -1.1 . . . . 0.0 108.562 173.036 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.08 -35.93 72.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.732 0.301 . . . . 0.0 111.685 -175.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.1 mp0 -69.07 -37.27 78.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.054 0.454 . . . . 0.0 110.703 -177.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.442 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 1.5 mm-40 -68.44 -44.34 75.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.505 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 75.9 mt -62.5 -41.58 92.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.438 179.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 49.7 t -56.71 -42.99 80.14 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.99 178.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.691 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 26.9 tt0 -68.27 -48.4 65.13 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.52 179.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.467 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.0 -44.69 78.88 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.277 -177.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.526 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.2 m-85 -57.73 -42.81 84.63 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.902 0.382 . . . . 0.0 111.123 177.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.1 m -66.69 -33.12 74.93 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.331 0.586 . . . . 0.0 110.588 -178.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.691 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 25.2 mtpp -71.87 -31.95 66.96 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.471 -178.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.673 HG11 ' HB2' ' A' ' 36' ' ' LEU . 11.7 m -82.7 -3.91 7.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.813 0.339 . . . . 0.0 111.08 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 101.73 16.46 24.04 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.8 177.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -123.92 91.39 49.69 Favored Pre-proline 0 C--N 1.322 -0.622 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -71.43 101.61 1.16 Allowed 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 122.033 1.822 . . . . 0.0 112.115 -176.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -108.37 147.93 30.84 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.489 177.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 43.1 p -85.47 162.43 18.96 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.001 175.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.4 tp -63.64 -33.17 75.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.265 0.555 . . . . 0.0 109.714 177.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -61.83 -42.36 98.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.55 178.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.418 ' O ' HG13 ' A' ' 82' ' ' ILE . 24.5 mm-40 -56.03 -49.6 73.24 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.593 177.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.7 mm -62.72 -49.69 82.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.965 -174.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -64.14 -39.29 93.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.892 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 18.3 tpp180 -64.28 -45.14 89.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.94 178.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 78' ' ' GLU . 96.8 mt -63.15 -34.11 64.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.847 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.7 mt -77.0 -20.8 55.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.255 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 47.3 m . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.885 -0.578 . . . . 0.0 110.481 -179.033 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt . . . . . 0 CA--C 1.526 0.045 0 CA-C-O 120.411 0.148 . . . . 0.0 110.925 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.533 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 63.2 mtm180 -64.72 -48.37 74.87 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 120.922 0.392 . . . . 0.0 109.956 177.174 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.564 ' O ' HG23 ' A' ' 33' ' ' VAL . 86.0 t -60.7 -42.55 92.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.185 176.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.5 t -58.93 -45.9 89.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.028 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -61.26 -36.19 79.34 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.006 0.432 . . . . 0.0 110.668 178.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.32 -44.58 62.48 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.048 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 29' ' ' VAL . 92.7 t -60.96 -43.51 96.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.799 0.333 . . . . 0.0 110.536 -179.29 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -68.76 -34.5 75.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.982 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -72.94 -43.37 62.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.061 0.457 . . . . 0.0 110.711 178.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.691 ' HB2' HG11 ' A' ' 70' ' ' VAL . 84.2 mt -65.66 -29.44 70.0 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.602 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.5 mt -84.18 6.36 22.84 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.585 -177.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.492 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 22.9 t70 -83.57 136.76 34.13 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.874 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.1 t -53.8 -43.68 69.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.038 -177.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -68.55 -42.67 78.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.157 0.503 . . . . 0.0 110.396 -177.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.502 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 86.9 t -66.94 -34.54 70.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.034 -179.171 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.492 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 83.9 mtp180 -67.19 -22.94 65.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.247 177.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 57.8 ttp180 -84.3 -18.12 37.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.751 0.31 . . . . 0.0 110.936 -178.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -85.73 158.68 56.35 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.66 -0.246 . . . . 0.0 110.709 175.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.45 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 31.7 Cg_endo -65.43 157.04 60.21 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 122.671 2.247 . . . . 0.0 112.574 -179.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.476 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.5 OUTLIER -60.37 -40.26 90.19 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.055 -177.411 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 11.0 m -58.12 -42.43 85.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.913 -177.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.43 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 56.4 m -62.75 -45.47 92.57 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.885 178.102 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.509 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 81.3 mttt -57.07 -49.37 76.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.996 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 46' ' ' THR . 99.6 t -64.77 -43.19 96.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.064 -176.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 29.0 m170 -64.45 -37.97 89.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.962 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.453 ' CE1' ' HE2' ' A' ' 56' ' ' LYS . 43.8 t80 -70.17 -42.77 72.02 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.514 -178.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 89.9 mt -64.0 -34.76 78.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.952 0.406 . . . . 0.0 110.801 178.558 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.447 ' HE3' ' HB3' ' A' ' 54' ' ' LYS . 0.5 OUTLIER -60.73 -43.5 97.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.336 175.199 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 45.8 m -69.79 -13.76 62.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.086 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 65.6 mttm -78.85 -8.18 58.58 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.315 174.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.4 20.72 28.99 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.047 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.533 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.7 mp -86.55 154.8 20.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.07 0.462 . . . . 0.0 111.254 178.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.512 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 13.1 m -93.84 161.87 14.15 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.19 174.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.24 -35.23 71.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.22 0.533 . . . . 0.0 110.875 -179.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -67.9 -38.89 83.54 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.527 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.512 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 4.2 mm-40 -65.89 -44.88 84.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.978 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 75.1 mt -62.04 -43.81 98.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.368 178.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 39.7 t -57.45 -44.17 84.54 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.753 176.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 70.1 tt0 -67.21 -47.28 71.33 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.838 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.514 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -57.45 -47.84 80.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.259 -179.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.596 ' O ' HG22 ' A' ' 70' ' ' VAL . 6.2 m-85 -57.05 -44.54 83.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.988 0.423 . . . . 0.0 111.087 178.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.1 m -65.09 -32.77 74.64 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.996 0.427 . . . . 0.0 110.626 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.471 ' HE3' HG21 ' A' ' 33' ' ' VAL . 19.1 mtmt -71.27 -31.7 67.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.75 179.069 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.691 HG11 ' HB2' ' A' ' 36' ' ' LEU . 11.0 m -82.29 -3.55 7.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-O 120.859 0.362 . . . . 0.0 111.439 -177.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 100.12 17.19 25.68 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.261 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.405 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 5.5 tp-100 -126.68 91.15 48.0 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -72.73 99.24 1.04 Allowed 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 121.706 1.604 . . . . 0.0 112.239 -176.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.476 ' HE3' HG21 ' A' ' 46' ' ' THR . 73.3 mmtt -107.59 137.37 45.74 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.193 175.447 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.452 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 76.7 p -80.69 159.41 25.29 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.398 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.418 ' HG ' ' HE2' ' A' ' 80' ' ' LYS . 52.6 tp -61.42 -33.22 73.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.813 178.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -61.16 -43.58 98.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.917 178.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.452 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 21.6 mm-40 -59.13 -49.71 76.84 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.608 178.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 45.1 mm -62.66 -44.14 99.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.189 -174.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.418 ' HE2' ' HG ' ' A' ' 76' ' ' LEU . 61.6 mttm -63.89 -38.62 91.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.807 0.337 . . . . 0.0 110.927 -179.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 18.3 tpt180 -67.73 -44.48 77.51 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.775 177.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 78' ' ' GLU . 90.7 mt -62.16 -37.82 79.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.874 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.432 HD21 HG12 ' A' ' 50' ' ' VAL . 81.4 mt -78.21 -25.85 47.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.551 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 C--O 1.252 1.191 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.691 -178.556 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 pttp . . . . . 0 N--CA 1.457 -0.108 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.476 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 39.8 mtm180 -66.05 -47.03 75.7 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.762 0.315 . . . . 0.0 110.523 179.233 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.498 ' O ' HG23 ' A' ' 33' ' ' VAL . 82.3 t -61.26 -42.68 94.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.215 177.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 35.8 m -58.69 -46.44 87.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.801 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -61.67 -36.0 79.58 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.083 0.468 . . . . 0.0 111.069 179.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.62 -44.41 62.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.006 179.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.517 HG13 HG12 ' A' ' 70' ' ' VAL . 75.6 t -60.82 -43.24 95.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.845 0.355 . . . . 0.0 110.575 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -69.22 -34.04 74.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.019 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -72.43 -43.52 63.71 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.885 0.374 . . . . 0.0 110.775 178.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.663 ' HB2' HG11 ' A' ' 70' ' ' VAL . 88.9 mt -66.51 -31.45 72.19 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.702 -177.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.6 mt -85.98 6.83 26.88 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.83 0.347 . . . . 0.0 111.918 -177.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.481 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 14.3 t70 -77.58 135.88 38.21 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 176.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.7 m -57.8 -36.17 71.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.74 0.305 . . . . 0.0 111.698 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -69.21 -41.56 76.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.196 0.522 . . . . 0.0 110.612 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.491 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 88.8 t -72.37 -32.93 44.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.876 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.481 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 24.6 mtp180 -66.08 -21.62 66.38 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.577 175.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -80.99 -17.88 48.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.132 -177.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -92.02 158.72 39.13 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.132 178.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.415 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 32.8 Cg_endo -64.82 156.9 59.27 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.885 2.39 . . . . 0.0 112.347 178.318 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.489 HG21 ' HE3' ' A' ' 74' ' ' LYS . 1.1 m -65.7 -38.08 88.23 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.599 -174.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.3 m -58.69 -38.43 78.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.951 0.405 . . . . 0.0 110.731 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 75.5 m -65.88 -44.25 85.92 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.827 176.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.491 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 86.8 mttt -57.27 -47.74 80.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.546 178.322 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 46' ' ' THR . 82.3 t -63.87 -46.1 95.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.167 -177.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -64.16 -37.21 86.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.983 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -64.08 -47.23 80.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.463 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 96.2 mt -64.04 -37.07 86.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.942 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -59.29 -43.26 92.57 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.13 0.49 . . . . 0.0 110.436 176.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.4 m -70.52 -16.6 62.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.505 -179.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.4 mmtp -85.41 -4.32 59.12 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 120.781 0.324 . . . . 0.0 111.199 177.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.81 13.71 31.27 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.73 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.476 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.0 mp -87.31 149.88 24.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.189 0.518 . . . . 0.0 111.709 178.059 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.44 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 16.8 m -94.04 167.63 11.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.519 175.44 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.73 -38.16 80.92 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -177.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -65.89 -37.51 86.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.112 0.482 . . . . 0.0 110.406 -179.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.44 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 3.1 mm-40 -64.46 -47.45 78.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.682 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.76 -45.47 98.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.627 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 53.7 t -58.13 -44.71 87.95 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.168 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.636 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 29.9 tt0 -67.48 -48.32 67.48 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.663 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.498 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.65 -44.02 80.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.458 -178.149 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.549 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.4 m-85 -58.53 -41.85 86.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.974 0.416 . . . . 0.0 111.207 179.057 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.8 m -65.77 -34.22 77.67 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.233 0.539 . . . . 0.0 110.422 -177.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.636 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 4.4 mtpm? -71.46 -31.2 66.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.957 179.249 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.663 HG11 ' HB2' ' A' ' 36' ' ' LEU . 11.0 m -83.48 4.13 2.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.811 0.338 . . . . 0.0 111.23 -178.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 94.02 17.45 40.6 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.606 176.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -127.1 91.55 46.42 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -70.28 98.26 0.73 Allowed 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 121.748 1.632 . . . . 0.0 112.328 -177.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.489 ' HE3' HG21 ' A' ' 46' ' ' THR . 71.6 mmtt -106.61 140.19 39.87 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.799 177.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 30.6 p -86.06 156.57 20.35 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.26 178.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 37.5 tp -62.42 -32.3 73.12 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -56.81 -45.48 82.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.501 176.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.419 ' O ' HG13 ' A' ' 82' ' ' ILE . 33.0 mt-10 -61.79 -48.76 79.18 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.71 177.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 46.4 mm -60.29 -46.27 95.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.839 -176.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -63.02 -38.06 89.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.948 178.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.1 tpp180 -67.9 -44.15 77.64 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.697 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 78' ' ' GLU . 93.6 mt -64.67 -36.49 77.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.845 -179.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.7 mt -78.98 -25.27 43.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.328 178.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 C--O 1.252 1.203 0 CA-C-O 119.053 -0.499 . . . . 0.0 110.578 -176.903 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? . . . . . 0 N--CA 1.457 -0.107 0 CA-C-O 120.595 0.236 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.503 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 35.2 mtm180 -67.21 -44.5 79.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.402 177.444 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.628 ' O ' HG23 ' A' ' 33' ' ' VAL . 87.5 t -61.1 -46.84 95.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.156 177.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.1 m -62.4 -43.77 98.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.343 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -61.78 -36.04 79.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.124 0.488 . . . . 0.0 110.537 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.468 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -69.94 -43.89 70.69 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.584 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.628 HG23 ' O ' ' A' ' 29' ' ' VAL . 90.3 t -60.32 -46.23 95.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.011 0.434 . . . . 0.0 110.393 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.89 -33.7 74.2 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.26 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -72.1 -43.7 64.37 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.787 0.327 . . . . 0.0 110.789 177.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.711 ' HB2' HG11 ' A' ' 70' ' ' VAL . 95.1 mt -65.02 -31.3 72.46 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.213 -179.058 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 37' ' ' LEU . 16.5 mt -85.84 5.84 30.9 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.991 -177.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.61 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 10.6 t70 -74.28 134.0 42.62 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 177.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 m -52.15 -36.7 52.24 Favored 'General case' 0 C--N 1.328 -0.365 0 O-C-N 123.386 0.428 . . . . 0.0 111.652 -176.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 84.5 mtm180 -68.86 -44.42 73.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.181 0.515 . . . . 0.0 110.978 178.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.529 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.3 t -70.96 -26.69 28.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.681 -176.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.61 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 52.1 mtt180 -62.39 -22.49 66.19 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.421 174.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -90.27 -18.4 25.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.73 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.1 p -81.57 152.71 70.21 Favored Pre-proline 0 C--N 1.326 -0.433 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.63 177.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.416 ' HG2' ' OG ' ' A' ' 48' ' ' SER . 26.4 Cg_endo -63.8 154.53 69.06 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.309 2.006 . . . . 0.0 111.912 177.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.417 ' O ' HG23 ' A' ' 50' ' ' VAL . 1.5 m -59.5 -39.54 84.16 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.249 -177.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.418 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 13.8 m -58.26 -42.26 86.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.843 -179.038 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.416 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 74.4 m -62.47 -44.27 96.81 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.152 178.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.529 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 84.7 mttt -57.65 -49.97 74.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.26 179.345 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.584 HG12 HD21 ' A' ' 83' ' ' LEU . 61.6 t -64.69 -40.96 90.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.113 -176.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 36.7 m170 -64.92 -38.37 90.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.903 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -64.68 -47.0 80.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.885 0.374 . . . . 0.0 110.359 179.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.477 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 90.1 mt -62.59 -37.68 87.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.134 -179.076 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.607 ' HD3' HD22 ' A' ' 83' ' ' LEU . 38.3 ttpt -60.74 -42.19 96.85 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.313 0.578 . . . . 0.0 110.029 175.048 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.6 t -63.19 -24.77 68.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.811 178.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -85.1 7.21 22.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.391 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.8 7.94 70.43 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.623 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.503 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.4 mp -75.85 147.74 38.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.349 0.595 . . . . 0.0 111.125 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.504 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 14.9 m -91.2 162.9 14.45 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.786 174.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.01 -35.93 71.95 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.99 0.424 . . . . 0.0 111.14 -177.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -63.91 -41.61 97.62 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.247 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.504 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 3.1 mm-40 -63.63 -45.63 89.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.422 0.63 . . . . 0.0 109.543 -178.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.436 HG23 HD12 ' A' ' 53' ' ' LEU . 63.2 mt -62.99 -43.65 99.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.709 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 40.3 t -56.59 -46.18 80.96 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.139 178.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -68.01 -47.68 67.79 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.698 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.561 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.92 -46.31 82.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.902 -179.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.576 ' O ' HG22 ' A' ' 70' ' ' VAL . 2.6 m-85 -57.21 -45.72 83.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.247 179.316 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.9 m -65.25 -33.46 76.04 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.436 -177.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.496 ' HE3' HG21 ' A' ' 33' ' ' VAL . 25.9 mtmt -72.63 -27.04 61.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.996 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.711 HG11 ' HB2' ' A' ' 36' ' ' LEU . 8.6 m -87.05 3.45 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-O 120.841 0.353 . . . . 0.0 111.217 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 94.56 15.77 45.4 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.571 -0.824 . . . . 0.0 112.623 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -124.17 91.58 49.39 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -71.71 99.79 0.99 Allowed 'Trans proline' 0 N--CA 1.455 -0.758 0 C-N-CA 121.997 1.798 . . . . 0.0 112.332 -176.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -113.12 140.94 47.47 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.922 176.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 33.2 p -82.93 167.91 17.54 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.596 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 60.5 tp -63.0 -33.86 76.32 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 174.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -62.23 -43.63 98.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.458 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -57.06 -48.58 78.22 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.818 178.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.9 mm -61.33 -48.88 86.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.825 -176.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -64.64 -35.38 80.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.846 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.8 tpt180 -61.98 -45.77 92.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.247 0.546 . . . . 0.0 110.348 175.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.418 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 78.4 mt -68.1 -33.96 63.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.172 -178.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.607 HD22 ' HD3' ' A' ' 54' ' ' LYS . 87.5 mt -81.79 -20.68 38.66 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.906 178.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 71.5 m . . . . . 0 C--O 1.252 1.223 0 CA-C-O 117.963 -1.018 . . . . 0.0 111.684 179.236 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt . . . . . 0 CA--C 1.527 0.077 0 CA-C-O 120.54 0.209 . . . . 0.0 110.546 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.5 mtm-85 -68.45 -41.24 80.55 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.571 ' O ' HG23 ' A' ' 33' ' ' VAL . 69.2 t -60.91 -44.87 98.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.303 -0.408 . . . . 0.0 109.994 174.308 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.1 m -58.77 -42.2 88.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.021 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.512 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 23.3 m-80 -66.48 -34.76 78.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.051 0.453 . . . . 0.0 110.994 177.153 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.59 -43.99 65.27 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.108 177.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 29' ' ' VAL . 94.4 t -61.25 -40.93 87.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.847 0.356 . . . . 0.0 110.752 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 12.3 pt-20 -68.94 -37.49 78.91 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.563 178.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -72.28 -43.53 64.12 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.161 -179.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.592 ' HB2' HG11 ' A' ' 70' ' ' VAL . 74.0 mt -65.1 -31.68 73.0 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.45 -179.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.3 mt -85.79 6.48 27.79 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -176.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -76.87 139.05 40.13 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 177.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.411 ' HA ' ' HG2' ' A' ' 42' ' ' ARG . 20.9 t -59.45 -31.78 69.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.85 0.357 . . . . 0.0 111.057 -178.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -68.53 -42.69 78.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.372 0.606 . . . . 0.0 110.549 178.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 93.6 t -79.52 -32.26 14.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.271 -171.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.411 ' HG2' ' HA ' ' A' ' 39' ' ' SER . 17.3 ptp180 -67.92 -22.2 65.08 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.118 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -83.98 -18.09 38.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.72 0.295 . . . . 0.0 111.496 -178.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.09 162.93 50.35 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 116.638 -0.256 . . . . 0.0 110.756 177.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -63.97 157.9 50.33 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.626 2.217 . . . . 0.0 112.376 179.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.419 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -62.69 -35.18 78.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.075 -178.388 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.556 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 14.6 p -58.73 -43.66 90.26 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.402 -178.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.3 m -61.12 -45.93 92.68 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.965 178.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.465 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 82.0 mttt -57.34 -50.3 73.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.564 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 92.1 t -65.57 -44.91 93.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.201 -174.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 27.3 m170 -64.48 -35.99 82.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.005 -177.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -70.19 -38.53 75.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.277 -178.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 82.5 mt -69.83 -37.62 76.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.699 178.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -62.56 -38.26 89.34 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.162 0.506 . . . . 0.0 109.851 174.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.5 t -67.1 -19.96 65.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.441 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 69.0 mmtt -80.81 -8.37 59.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.768 177.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.07 15.67 38.08 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.601 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.9 mp -80.94 145.56 31.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.104 0.478 . . . . 0.0 111.402 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.2 m -82.28 163.46 21.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.539 173.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.73 -41.1 85.63 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.843 0.354 . . . . 0.0 111.246 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -70.55 -30.37 67.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.393 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -66.97 -45.73 76.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.225 0.535 . . . . 0.0 109.941 175.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 64.7 mt -62.67 -43.09 98.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.232 177.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 43.9 t -56.76 -43.62 80.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.836 176.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.98 -48.56 65.46 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.824 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.1 -42.62 81.09 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.281 -179.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.464 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.3 m-85 -60.8 -47.57 85.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.917 177.601 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 21.8 m -64.07 -34.96 79.21 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.04 0.448 . . . . 0.0 110.255 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mmmt -62.79 -35.39 79.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.602 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.592 HG11 ' HB2' ' A' ' 36' ' ' LEU . 22.4 m -87.42 7.23 2.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -176.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.6 18.39 48.64 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.657 177.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -123.75 90.97 50.18 Favored Pre-proline 0 C--N 1.322 -0.613 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 177.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -71.92 97.71 0.84 Allowed 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 121.903 1.736 . . . . 0.0 112.437 -176.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.419 ' HE3' HG21 ' A' ' 46' ' ' THR . 69.3 mmtt -106.97 137.96 44.06 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.848 176.119 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.7 p -80.64 162.05 24.4 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.409 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 64.7 tp -61.42 -33.61 74.0 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 175.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -60.18 -44.32 95.14 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.365 176.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.441 ' O ' HG13 ' A' ' 82' ' ' ILE . 8.7 mm-40 -61.21 -47.3 86.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.125 177.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.8 mm -60.13 -47.44 91.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.888 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -62.42 -40.85 97.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.13 0.491 . . . . 0.0 110.548 177.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -59.89 -47.02 87.45 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.747 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.556 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 88.8 mt -66.72 -31.64 54.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.09 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.1 mt -77.73 -12.57 59.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.204 178.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 25.9 p . . . . . 0 C--O 1.252 1.187 0 CA-C-O 119.036 -0.507 . . . . 0.0 110.577 177.305 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt . . . . . 0 N--CA 1.456 -0.155 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.483 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 34.8 mtm180 -63.19 -46.31 87.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 0.0 110.506 178.149 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.575 ' O ' HG23 ' A' ' 33' ' ' VAL . 97.9 t -61.74 -46.76 95.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.589 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.1 p -62.0 -38.51 88.88 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.247 -0.181 . . . . 0.0 111.428 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -61.15 -41.14 96.21 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.23 0.538 . . . . 0.0 110.37 176.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.69 -44.84 63.52 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.117 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.575 HG23 ' O ' ' A' ' 29' ' ' VAL . 87.0 t -61.49 -42.14 92.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.745 -179.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -69.23 -36.13 76.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.644 0.259 . . . . 0.0 110.829 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -71.97 -43.8 64.58 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.875 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.699 ' HB2' HG11 ' A' ' 70' ' ' VAL . 86.9 mt -65.74 -29.98 70.57 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.538 -178.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.509 ' HG ' HG12 ' A' ' 70' ' ' VAL . 12.2 mt -85.13 6.32 26.11 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -176.204 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.491 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 25.6 t70 -79.51 138.71 37.62 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.348 177.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.441 ' O ' ' HG2' ' A' ' 43' ' ' ARG . 23.1 m -57.04 -41.57 78.87 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -176.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.9 mmp_? -68.71 -38.55 80.34 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.087 0.47 . . . . 0.0 110.206 179.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.4 ' O ' ' NZ ' ' A' ' 49' ' ' LYS . 61.9 t -71.64 -25.15 24.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.387 179.109 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.491 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 71.0 mtp180 -72.75 -20.53 61.17 Favored 'General case' 0 C--N 1.319 -0.738 0 O-C-N 122.051 -0.406 . . . . 0.0 110.895 172.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.441 ' HG2' ' O ' ' A' ' 39' ' ' SER . 32.4 mmm180 -96.18 10.73 36.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.738 -177.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.502 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -110.12 168.08 8.15 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.677 178.249 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.502 ' HD2' HG22 ' A' ' 44' ' ' THR . 57.9 Cg_endo -70.73 156.26 61.14 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.425 2.083 . . . . 0.0 111.71 175.332 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.45 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -67.21 -34.01 76.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.898 0.38 . . . . 0.0 111.067 -177.138 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.489 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 11.5 p -58.39 -42.16 86.49 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.513 -176.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.9 m -61.6 -42.33 98.71 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.877 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.496 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 21.1 mttm -63.97 -47.41 80.5 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.654 -178.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.482 HG12 HD21 ' A' ' 83' ' ' LEU . 68.5 t -63.82 -44.41 98.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.743 -175.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -65.11 -40.52 94.64 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.743 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -62.53 -47.36 84.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.586 178.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 89.9 mt -64.58 -36.47 84.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.982 -178.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.481 ' HD2' HD22 ' A' ' 83' ' ' LEU . 78.9 tttt -64.3 -38.12 89.91 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 120.929 0.395 . . . . 0.0 110.241 176.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.2 t -66.68 -25.19 66.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.058 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.7 mmtt -78.12 -4.29 46.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.078 178.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.8 8.46 54.26 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.457 178.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.483 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.8 mp -80.43 146.62 31.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.454 0.645 . . . . 0.0 111.333 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.3 m -89.41 165.74 14.16 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.328 175.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.0 -37.27 76.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.962 0.41 . . . . 0.0 110.958 -178.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -64.13 -42.5 96.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.708 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -64.11 -44.81 91.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.38 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.45 HG23 HD12 ' A' ' 53' ' ' LEU . 77.2 mt -61.51 -42.89 95.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.299 178.065 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 43.5 t -57.88 -46.0 85.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.967 177.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -68.11 -45.11 74.6 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.247 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.44 -41.74 81.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.61 0.243 . . . . 0.0 111.207 -178.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.482 ' O ' HG22 ' A' ' 70' ' ' VAL . 8.9 m-85 -61.48 -46.33 90.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.052 0.453 . . . . 0.0 110.595 176.247 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 20.2 m -63.25 -32.84 74.35 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.089 0.471 . . . . 0.0 110.402 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 12.7 mmmt -66.74 -33.37 75.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.882 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.699 HG11 ' HB2' ' A' ' 36' ' ' LEU . 22.0 m -87.22 -0.17 7.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.729 0.299 . . . . 0.0 111.632 -177.428 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 99.27 16.29 30.29 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.579 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -122.86 91.43 49.73 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 178.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -70.84 100.57 0.96 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 121.786 1.657 . . . . 0.0 112.125 -177.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.45 ' HE3' HG21 ' A' ' 46' ' ' THR . 67.5 mmtt -105.22 142.6 34.71 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.679 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 41.6 p -83.12 156.01 23.51 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.289 178.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.87 -32.56 73.83 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 177.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.5 t30 -58.28 -45.78 87.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.748 177.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -59.3 -46.68 87.91 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.189 179.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 41.6 mm -60.3 -45.47 96.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.524 -177.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -64.29 -39.85 94.77 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.015 0.436 . . . . 0.0 110.858 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 64.5 ttt180 -60.11 -46.56 89.21 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.548 177.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.489 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 89.8 mt -67.35 -31.94 55.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.305 -0.862 . . . . 0.0 111.298 -179.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.482 HD21 HG12 ' A' ' 50' ' ' VAL . 90.4 mt -83.14 -14.25 53.95 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.332 179.001 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 21.8 p . . . . . 0 C--O 1.25 1.103 0 C-N-CA 123.653 0.781 . . . . 0.0 111.76 -179.242 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.9 pttm . . . . . 0 N--CA 1.454 -0.238 0 CA-C-O 120.325 0.107 . . . . 0.0 110.953 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.449 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 25.0 mtm180 -67.64 -48.1 67.69 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.772 0.32 . . . . 0.0 110.398 178.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.593 ' O ' HG23 ' A' ' 33' ' ' VAL . 98.3 t -60.94 -39.95 83.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.821 176.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.8 t -58.37 -45.45 88.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.502 178.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.441 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 93.3 m-20 -62.59 -37.74 87.43 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.733 178.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.66 -45.04 63.17 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.414 -179.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.593 HG23 ' O ' ' A' ' 29' ' ' VAL . 93.1 t -61.16 -41.91 91.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.87 0.367 . . . . 0.0 110.654 -178.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 10.4 pt-20 -68.93 -37.5 78.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.713 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -71.6 -43.01 67.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.936 0.398 . . . . 0.0 110.841 -179.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.672 ' HB2' HG11 ' A' ' 70' ' ' VAL . 84.0 mt -65.01 -30.39 71.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.577 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.3 mt -85.18 7.03 23.32 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -176.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.496 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 11.3 t70 -80.12 135.95 36.42 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 176.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.457 ' O ' ' HG3' ' A' ' 43' ' ' ARG . 15.4 p -57.12 -36.95 71.27 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.871 0.367 . . . . 0.0 111.48 -176.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 80.7 mtm180 -68.58 -38.96 81.11 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.273 0.559 . . . . 0.0 110.262 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 57.9 t -78.5 -25.03 13.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.228 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 79.7 mtp180 -72.69 -33.12 66.27 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.72 -0.392 . . . . 0.0 112.043 178.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 39' ' ' SER . 77.1 mtp180 -81.32 -10.25 59.6 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -173.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.522 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -79.41 173.54 7.56 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.76 -0.2 . . . . 0.0 110.632 177.087 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.522 ' HD2' HG22 ' A' ' 44' ' ' THR . 46.4 Cg_endo -68.62 155.65 68.19 Favored 'Trans proline' 0 C--O 1.239 0.54 0 C-N-CA 121.941 1.761 . . . . 0.0 111.249 171.003 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.37 -33.69 74.72 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.812 0.339 . . . . 0.0 111.019 -177.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.457 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 15.4 p -57.78 -42.64 84.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.259 -176.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.1 m -62.1 -43.82 97.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.111 -179.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -62.05 -47.43 84.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.476 -177.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 76.6 t -64.53 -43.52 96.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.73 -177.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 37.8 m170 -64.87 -37.71 88.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.504 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -63.86 -51.24 65.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.436 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.412 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 91.6 mt -62.24 -36.28 81.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.063 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.19 -43.42 95.92 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.23 0.538 . . . . 0.0 110.309 176.566 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.2 t -70.68 -14.21 62.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.238 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -86.73 0.75 54.11 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.843 0.354 . . . . 0.0 110.925 177.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.65 10.32 50.49 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.475 177.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.449 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.8 mp -88.56 148.02 24.31 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.372 0.606 . . . . 0.0 111.119 178.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.401 ' O ' HG13 ' A' ' 63' ' ' ILE . 50.9 m -95.28 173.13 7.7 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.942 -1.027 . . . . 0.0 109.771 176.085 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.83 87.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.924 0.392 . . . . 0.0 111.313 -177.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -67.58 -35.51 79.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.261 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -64.17 -45.98 86.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.459 0.647 . . . . 0.0 109.51 178.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 59' ' ' SER . 64.4 mt -65.19 -43.65 95.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.816 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 53.2 t -57.36 -43.22 83.32 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.915 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.47 -48.62 66.65 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.762 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.495 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -57.2 -47.62 80.81 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.198 -178.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.552 ' O ' HG22 ' A' ' 70' ' ' VAL . 5.1 m-85 -56.93 -45.83 82.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.278 179.115 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.6 m -64.91 -33.14 75.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.965 0.412 . . . . 0.0 110.584 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.1 mtmt -70.56 -31.62 68.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.973 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.672 HG11 ' HB2' ' A' ' 36' ' ' LEU . 14.3 m -83.68 -3.78 7.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.836 0.35 . . . . 0.0 111.457 -176.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 101.14 18.49 19.48 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.339 178.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -126.87 91.39 47.21 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 177.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -72.87 101.72 1.35 Allowed 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 121.711 1.608 . . . . 0.0 112.281 -176.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -111.26 140.51 45.76 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.64 175.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 47.3 p -81.92 165.52 20.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.956 0.408 . . . . 0.0 110.474 177.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.4 -33.02 74.64 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.784 177.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -63.49 -42.15 98.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.076 178.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.503 ' O ' HG13 ' A' ' 82' ' ' ILE . 2.7 mm-40 -58.14 -48.19 81.01 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.829 177.002 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 42.3 mm -62.69 -42.11 94.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.468 -178.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -61.96 -43.69 98.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.974 0.416 . . . . 0.0 110.572 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 27.2 tpt180 -60.67 -45.89 92.43 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.353 -0.839 . . . . 0.0 111.078 178.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 78' ' ' GLU . 82.8 mt -67.91 -35.6 72.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.102 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 71.5 mt -77.8 -13.4 59.9 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 -179.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 20.8 p . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.474 -0.774 . . . . 0.0 109.975 175.675 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? . . . . . 0 N--CA 1.455 -0.18 0 CA-C-O 120.333 0.111 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.453 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 28.2 mtm180 -66.51 -41.11 89.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.502 0.191 . . . . 0.0 110.772 178.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.423 ' O ' HG23 ' A' ' 33' ' ' VAL . 70.6 t -63.09 -41.96 94.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 175.491 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.4 m -58.6 -46.96 85.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.262 176.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -62.37 -38.41 89.46 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.142 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.441 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -70.43 -45.34 66.05 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.168 -177.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.581 HG13 HG12 ' A' ' 70' ' ' VAL . 71.3 t -61.5 -44.68 98.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.877 0.37 . . . . 0.0 110.454 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -69.43 -33.66 73.29 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.924 -179.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -71.4 -43.07 67.51 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.953 0.406 . . . . 0.0 110.388 179.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.682 ' HB2' HG11 ' A' ' 70' ' ' VAL . 90.4 mt -64.27 -29.22 70.32 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.27 178.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.4 mt -85.35 6.5 26.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.168 -0.469 . . . . 0.0 112.084 -178.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -82.13 139.0 34.62 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.214 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.503 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 25.1 t -58.21 -37.4 74.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.628 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -68.18 -37.03 80.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.16 0.505 . . . . 0.0 110.438 -179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.572 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.0 t -79.33 -34.21 16.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.34 -176.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.503 ' HG2' ' O ' ' A' ' 39' ' ' SER . 39.6 ptt180 -68.26 -22.21 64.77 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.79 0.329 . . . . 0.0 110.543 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.2 ttp180 -84.75 -19.22 33.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.867 -178.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.22 161.35 49.44 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.92 178.336 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.415 ' HG2' ' OG ' ' A' ' 48' ' ' SER . 32.6 Cg_endo -63.53 155.99 59.43 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.687 2.258 . . . . 0.0 112.264 177.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.425 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.8 OUTLIER -61.69 -38.28 87.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.291 -177.509 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.8 m -58.76 -41.13 85.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.01 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.415 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 62.2 m -61.77 -45.99 91.51 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.801 178.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.572 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 80.1 mttt -56.91 -49.18 76.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.241 178.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.433 HG13 HG21 ' A' ' 63' ' ' ILE . 84.5 t -63.23 -45.28 98.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.143 -177.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 39.8 m170 -64.83 -37.24 86.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.964 -178.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -66.71 -45.99 76.98 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.691 0.281 . . . . 0.0 110.349 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 88.1 mt -62.23 -37.4 85.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.69 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.2 tppt? -59.79 -42.55 93.62 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.152 174.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.6 m -67.51 -15.32 63.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.973 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 27.6 mmtp -86.77 -4.6 59.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.901 177.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.15 7.68 55.93 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.858 -0.686 . . . . 0.0 112.753 178.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.453 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 5.1 mp -73.13 150.4 42.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.368 0.604 . . . . 0.0 111.602 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.6 m -90.88 161.28 15.29 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.362 -0.835 . . . . 0.0 108.78 173.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.27 -38.71 77.51 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.989 0.424 . . . . 0.0 110.498 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.474 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 1.8 mp0 -59.64 -43.16 93.95 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.716 177.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.11 -43.66 77.9 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.77 -178.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.433 HG21 HG13 ' A' ' 50' ' ' VAL . 74.7 mt -60.78 -44.34 97.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.079 176.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 52.9 t -59.37 -43.94 92.8 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.721 178.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.715 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 30.3 tt0 -67.53 -48.99 65.43 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.879 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.477 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.65 -45.24 81.74 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 120.54 0.21 . . . . 0.0 111.047 -178.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.569 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.7 m-85 -57.04 -44.95 83.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.927 0.394 . . . . 0.0 111.055 177.448 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.8 m -65.14 -33.14 75.32 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.251 0.548 . . . . 0.0 110.485 -177.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.715 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 20.7 mtpp -71.65 -32.34 67.82 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.797 -179.21 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.682 HG11 ' HB2' ' A' ' 36' ' ' LEU . 15.2 m -81.9 -4.41 7.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 121.049 -0.261 . . . . 0.0 111.314 -177.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 102.04 16.66 22.84 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.407 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.421 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 5.6 tp-100 -126.79 90.93 48.43 Favored Pre-proline 0 C--N 1.323 -0.587 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -74.02 99.43 1.17 Allowed 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 121.974 1.783 . . . . 0.0 112.268 -176.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.425 ' HE3' HG21 ' A' ' 46' ' ' THR . 72.7 mmtt -106.46 138.08 43.29 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.557 175.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.425 ' O ' HG12 ' A' ' 79' ' ' ILE . 63.7 p -77.32 156.31 31.41 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 37.8 tp -62.94 -32.69 74.06 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -60.79 -46.08 91.88 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.626 175.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -60.44 -43.76 96.48 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.383 178.357 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 75' ' ' THR . 45.7 mm -60.35 -43.25 93.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.533 0.206 . . . . 0.0 110.684 -178.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -63.98 -41.35 97.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.295 0.569 . . . . 0.0 110.649 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -59.8 -42.45 93.44 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.825 177.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 79.8 mt -73.91 -32.69 34.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.288 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 64.3 mt -80.92 -1.97 45.7 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.248 1.011 0 CA-C-O 119.144 -0.455 . . . . 0.0 110.485 175.857 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.0 pttt . . . . . 0 N--CA 1.45 -0.447 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.531 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 31.9 mtm180 -65.9 -44.22 85.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.746 -0.206 . . . . 0.0 110.65 177.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.566 ' O ' HG23 ' A' ' 33' ' ' VAL . 94.5 t -60.75 -44.56 97.6 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.159 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 174.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 29.6 m -58.71 -44.17 90.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.749 178.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -62.77 -37.07 85.17 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.169 0.509 . . . . 0.0 110.763 177.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.03 -44.41 63.44 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.914 -178.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.566 HG23 ' O ' ' A' ' 29' ' ' VAL . 92.9 t -61.38 -42.9 95.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.458 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.5 -36.79 76.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.662 0.268 . . . . 0.0 110.938 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -71.48 -42.95 67.43 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.945 0.402 . . . . 0.0 110.636 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.679 ' HB2' HG11 ' A' ' 70' ' ' VAL . 80.6 mt -66.97 -30.75 70.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.196 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.566 ' HG ' HG12 ' A' ' 70' ' ' VAL . 12.6 mt -85.38 7.49 22.3 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.628 -178.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -81.16 137.98 35.89 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.058 175.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.444 ' HA ' ' HG2' ' A' ' 42' ' ' ARG . 15.8 m -61.53 -36.45 80.61 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.773 -176.366 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.47 ' H ' ' HD2' ' A' ' 40' ' ' ARG . 3.6 mpt_? -70.33 -39.38 74.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.225 0.535 . . . . 0.0 109.66 -179.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.48 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 91.3 t -76.36 -36.78 30.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.603 -177.589 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.444 ' HG2' ' HA ' ' A' ' 39' ' ' SER . 40.2 ptt180 -65.91 -20.18 66.13 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 121.937 -0.477 . . . . 0.0 109.792 176.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 28.2 tpt180 -83.07 -19.03 37.61 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.545 179.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 p -82.4 161.18 60.31 Favored Pre-proline 0 C--N 1.33 -0.241 0 O-C-N 122.144 -0.347 . . . . 0.0 111.081 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -59.94 149.74 82.23 Favored 'Trans proline' 0 C--O 1.237 0.428 0 C-N-CA 122.641 2.227 . . . . 0.0 112.032 176.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.88 -36.39 76.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.247 -177.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.7 p -58.56 -42.61 88.34 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.121 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 52.0 m -62.06 -45.86 91.67 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.065 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.504 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 82.3 mttt -57.09 -49.91 74.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.326 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 81.3 t -63.58 -44.88 98.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.012 -177.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -64.83 -38.69 91.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.306 -177.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -64.63 -47.89 76.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.667 0.27 . . . . 0.0 110.469 178.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 86.1 mt -62.23 -41.05 98.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.203 -178.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.415 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 38.0 tptt -61.57 -42.27 98.6 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 120.923 0.392 . . . . 0.0 110.266 177.46 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.9 m -67.45 -17.33 64.66 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.106 179.262 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.18 -3.59 52.7 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.882 0.372 . . . . 0.0 110.982 177.018 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.24 8.34 47.41 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.922 176.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.531 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.4 mp -75.11 157.15 35.18 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.631 0.729 . . . . 0.0 111.821 -179.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.8 m -95.05 160.69 14.45 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.947 172.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.67 -37.69 76.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.897 0.379 . . . . 0.0 111.386 -177.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -70.66 -29.49 65.85 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.438 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -71.37 -44.36 65.16 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.073 0.463 . . . . 0.0 110.233 177.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 60.0 mt -62.49 -42.1 94.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.048 176.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 48.3 t -56.77 -46.29 81.55 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.267 -0.878 . . . . 0.0 110.963 178.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -66.59 -47.53 72.42 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.666 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.24 -42.07 80.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.595 -176.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.416 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.1 m-85 -61.45 -44.96 96.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.088 0.47 . . . . 0.0 110.78 176.391 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.1 m -64.71 -33.63 76.42 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.202 0.525 . . . . 0.0 110.297 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.7 mmmt -62.98 -36.56 83.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.38 178.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.679 HG11 ' HB2' ' A' ' 36' ' ' LEU . 19.7 m -89.61 3.69 6.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -174.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.06 18.42 29.29 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.275 -0.964 . . . . 0.0 112.9 177.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.404 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 5.7 tp-100 -126.77 90.83 48.69 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.202 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -71.6 100.34 1.03 Allowed 'Trans proline' 0 N--CA 1.461 -0.4 0 C-N-CA 121.955 1.77 . . . . 0.0 112.816 -175.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -108.33 146.38 33.05 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.989 176.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 39.1 p -89.37 165.84 14.11 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.593 177.65 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 61.0 tp -63.32 -35.19 79.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.277 0.56 . . . . 0.0 109.599 174.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.95 -40.5 96.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.594 178.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.477 ' O ' HG13 ' A' ' 82' ' ' ILE . 12.5 mm-40 -56.92 -49.27 76.12 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.592 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.5 mm -63.02 -45.44 98.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.742 -176.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -57.63 -42.53 83.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.145 0.497 . . . . 0.0 111.177 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -66.4 -48.02 71.43 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.771 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 78' ' ' GLU . 86.5 mt -62.25 -36.19 73.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.289 -178.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.7 mt -78.09 -25.79 47.76 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.078 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 69.9 m . . . . . 0 C--O 1.249 1.054 0 O-C-N 123.84 0.712 . . . . 0.0 112.288 179.47 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? . . . . . 0 C--O 1.226 -0.174 0 N-CA-C 110.843 -0.058 . . . . 0.0 110.843 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.439 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 20.6 mtm180 -58.88 -48.97 79.5 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 120.893 0.378 . . . . 0.0 110.6 177.485 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.561 ' O ' HG23 ' A' ' 33' ' ' VAL . 99.2 t -63.12 -45.15 99.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.192 177.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.1 t -58.58 -45.23 89.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.728 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -62.12 -38.72 89.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.072 0.463 . . . . 0.0 110.768 179.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.23 -43.89 63.71 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.066 179.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 29' ' ' VAL . 69.2 t -60.95 -43.18 95.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.553 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -69.65 -35.45 75.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.724 0.297 . . . . 0.0 111.062 179.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -72.6 -43.13 63.74 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 120.991 0.424 . . . . 0.0 110.908 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.632 ' HB2' HG11 ' A' ' 70' ' ' VAL . 91.5 mt -65.71 -30.41 71.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.847 179.319 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.6 mt -85.82 7.15 25.0 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.526 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -78.76 138.87 38.43 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.835 0.35 . . . . 0.0 110.627 -178.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.605 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 14.9 t -57.87 -35.21 70.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.329 -178.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -69.87 -38.84 76.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.148 0.499 . . . . 0.0 110.984 178.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.6 t -79.39 -27.91 13.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.739 -174.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.605 ' HG2' ' O ' ' A' ' 39' ' ' SER . 39.0 ptt180 -64.13 -21.84 66.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.953 0.406 . . . . 0.0 110.735 178.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -88.27 -17.54 30.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.032 -179.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.8 p -86.01 157.04 57.51 Favored Pre-proline 0 C--N 1.326 -0.43 0 C-N-CA 121.055 -0.258 . . . . 0.0 111.089 179.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.423 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 35.7 Cg_endo -64.88 159.81 44.17 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.718 2.278 . . . . 0.0 112.149 177.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.576 HG21 ' HE3' ' A' ' 74' ' ' LYS . 1.3 m -59.8 -41.53 91.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.024 -178.222 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.459 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 10.1 m -58.65 -40.56 83.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.34 -176.142 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.6 m -63.57 -42.38 98.33 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 120.719 0.295 . . . . 0.0 110.999 177.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 45' ' ' PRO . 80.8 mttt -59.79 -48.32 82.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.124 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 58.5 t -65.84 -43.22 93.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.887 -177.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 37.1 m170 -62.84 -39.61 94.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.598 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -64.24 -51.08 65.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.554 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 94.9 mt -60.55 -38.69 85.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.969 -178.02 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.37 -44.18 97.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.165 0.507 . . . . 0.0 110.152 176.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 18.5 m -64.77 -19.34 65.76 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.445 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -85.22 -1.37 56.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.275 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 96.01 12.71 51.82 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.619 177.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.439 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.6 mp -81.57 152.63 27.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.051 0.453 . . . . 0.0 111.033 177.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.512 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 17.8 m -95.6 163.97 12.98 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.422 176.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.18 -37.57 75.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.889 0.376 . . . . 0.0 111.349 -177.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -65.01 -40.76 95.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.485 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.512 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 4.6 mm-40 -64.28 -45.1 89.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.309 0.576 . . . . 0.0 109.514 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 76.6 mt -63.03 -45.48 98.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.9 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 48.2 t -56.81 -45.29 82.35 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.298 -179.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -68.13 -47.36 68.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.806 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.13 -41.78 79.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.486 -179.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.418 ' O ' HG22 ' A' ' 70' ' ' VAL . 2.8 m-85 -59.32 -47.97 83.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.946 177.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.0 m -63.98 -32.63 74.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.23 0.538 . . . . 0.0 110.322 -179.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mmmt -65.51 -33.99 77.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.065 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.632 HG11 ' HB2' ' A' ' 36' ' ' LEU . 26.0 m -89.14 5.78 4.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.742 0.306 . . . . 0.0 111.701 -177.256 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.78 22.37 33.73 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.532 -0.842 . . . . 0.0 112.326 178.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -127.36 91.03 47.22 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 175.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -70.1 104.45 1.37 Allowed 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 121.788 1.659 . . . . 0.0 112.168 -177.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.576 ' HE3' HG21 ' A' ' 46' ' ' THR . 72.5 mmtt -115.12 137.52 51.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.318 176.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 73.9 p -81.76 162.3 22.97 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 178.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 55.1 tp -62.39 -33.14 74.18 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.417 0.627 . . . . 0.0 109.41 177.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -61.9 -45.2 94.75 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.553 177.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -59.41 -47.0 87.14 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.038 179.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 43.5 mm -59.53 -46.21 93.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.563 -177.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -64.48 -38.43 90.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.027 0.441 . . . . 0.0 111.192 178.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -66.03 -41.41 90.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.822 178.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.459 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 81.1 mt -67.1 -32.22 56.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.23 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 98.7 mt -78.13 -20.82 51.35 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.051 178.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 12.4 m . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.593 -177.567 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 33.4 pttt . . . . . 0 N--CA 1.481 1.091 0 N-CA-C 110.689 -0.115 . . . . 0.0 110.689 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.08 117.37 5.12 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.27 1.98 . . . . 0.0 110.714 171.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -84.34 93.74 8.31 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.347 0.594 . . . . 0.0 109.805 -175.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 44.6 t -94.38 -35.55 6.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.713 -177.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -128.9 -170.45 2.27 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.813 178.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 39.5 m80 -100.3 164.04 12.12 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.0 m -59.98 98.53 0.06 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.904 0.383 . . . . 0.0 110.948 -178.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -71.12 -24.48 62.29 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.091 -174.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 28.5 m -65.68 -33.69 76.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.969 0.414 . . . . 0.0 110.032 176.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.54 ' O ' ' HG2' ' A' ' 27' ' ' LYS . 38.7 tt0 -71.5 -41.46 69.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.957 179.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -66.27 -46.9 75.43 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.313 175.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -57.34 -40.98 79.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.539 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 17.2 pttp -72.19 -32.21 66.61 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 121.043 -0.263 . . . . 0.0 111.013 -178.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.505 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 82.8 mtm-85 -67.8 -44.06 78.23 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 176.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.537 ' O ' HG23 ' A' ' 33' ' ' VAL . 87.6 t -61.41 -38.5 80.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.745 175.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.2 t -58.32 -45.66 87.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.413 177.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -61.87 -36.6 81.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.22 178.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.39 -45.25 55.88 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.235 -179.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 29' ' ' VAL . 94.7 t -62.4 -40.0 86.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.764 -178.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -68.92 -38.75 79.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.796 0.331 . . . . 0.0 110.753 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -71.74 -42.6 67.06 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.745 -178.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.676 ' HB2' HG11 ' A' ' 70' ' ' VAL . 89.8 mt -67.28 -30.92 70.93 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.155 179.448 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.48 ' HG ' HG12 ' A' ' 70' ' ' VAL . 9.6 mt -85.32 6.04 28.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.565 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.634 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 12.2 t70 -73.94 128.91 36.77 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -53.52 -44.0 68.78 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -175.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 86.1 mtm180 -69.11 -33.59 73.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.292 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.535 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 98.5 t -73.59 -28.68 25.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.159 0.504 . . . . 0.0 110.419 178.022 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.634 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 90.9 mtt180 -62.43 -22.26 66.05 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.042 0.449 . . . . 0.0 110.322 173.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 34.9 ttm180 -93.46 -17.07 23.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.332 -177.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.6 p -80.31 158.32 71.91 Favored Pre-proline 0 C--N 1.33 -0.277 0 O-C-N 122.269 -0.269 . . . . 0.0 110.654 174.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.411 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 36.9 Cg_endo -67.05 156.3 66.95 Favored 'Trans proline' 0 C--O 1.234 0.324 0 C-N-CA 122.595 2.196 . . . . 0.0 112.234 178.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.508 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -59.66 -37.91 80.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.924 -177.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.6 p -58.42 -42.77 87.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.466 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.9 m -63.97 -42.68 97.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.118 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.535 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 78.4 mttt -60.88 -49.45 77.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.284 178.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 46' ' ' THR . 63.7 t -65.18 -44.62 95.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.187 -174.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 15.7 m170 -63.31 -37.83 88.79 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.217 -177.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -70.57 -45.57 65.15 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.897 -178.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 91.8 mt -61.99 -40.19 94.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.049 -178.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.471 ' HD2' ' C ' ' A' ' 54' ' ' LYS . 0.9 OUTLIER -59.77 -43.7 94.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.323 0.583 . . . . 0.0 109.888 177.521 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.4 m -68.7 -14.36 62.97 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.396 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 35.5 mtpt -87.58 3.67 46.67 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.949 177.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.72 2.4 52.76 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.994 174.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.505 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.8 mp -78.24 154.66 30.83 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.372 0.606 . . . . 0.0 111.663 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.401 ' O ' HG13 ' A' ' 63' ' ' ILE . 16.2 m -95.9 161.22 14.09 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.309 173.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.9 -38.66 76.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.855 0.359 . . . . 0.0 111.284 -177.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.02 -37.42 87.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.988 178.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -71.53 -39.26 70.85 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.386 -179.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 59' ' ' SER . 80.6 mt -63.16 -43.96 99.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.189 176.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 40.7 t -56.71 -42.19 78.73 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.913 177.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -68.18 -48.54 64.99 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.917 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.21 -41.91 80.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.403 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.427 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.8 m-85 -58.81 -46.58 87.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.95 0.405 . . . . 0.0 110.83 176.353 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 20.8 m -65.21 -33.05 75.08 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.108 0.48 . . . . 0.0 110.081 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -63.28 -35.77 81.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.642 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.676 HG11 ' HB2' ' A' ' 36' ' ' LEU . 23.0 m -88.46 5.23 4.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-O 120.992 0.425 . . . . 0.0 111.643 -177.279 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 93.53 18.89 36.8 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.662 177.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -121.58 91.01 48.37 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.55 99.46 1.22 Allowed 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 121.982 1.788 . . . . 0.0 112.368 -177.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -109.85 144.29 38.51 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.645 176.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.435 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 24.3 p -81.79 157.81 24.35 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 175.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 53.6 tp -60.78 -32.66 71.97 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.107 0.479 . . . . 0.0 110.568 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -59.78 -42.19 92.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.745 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.435 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 58.1 mm-40 -59.47 -48.66 80.79 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.291 178.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 46.1 mm -60.36 -48.41 88.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.037 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -63.48 -38.14 90.0 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.861 0.362 . . . . 0.0 110.648 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.6 ttm180 -61.95 -48.71 79.17 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.924 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 78' ' ' GLU . 69.2 mt -64.34 -33.09 60.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.072 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.409 HD21 HG12 ' A' ' 50' ' ' VAL . 79.2 mt -79.2 -17.25 55.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.766 -179.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.6 p . . . . . 0 C--O 1.252 1.206 0 CA-C-O 118.308 -0.853 . . . . 0.0 110.621 179.598 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.7 pttp . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -63.67 134.87 46.09 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.127 1.884 . . . . 0.0 111.739 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -105.89 95.73 6.0 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.259 0.552 . . . . 0.0 110.819 -178.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 60.9 t -117.88 98.66 6.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.452 -0.794 . . . . 0.0 108.961 177.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -100.29 93.79 5.86 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.84 -176.158 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 47.3 t-80 -94.86 94.08 7.84 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.2 m -66.56 109.2 2.7 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.254 -175.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 5.3 p-80 -66.01 -28.81 69.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.759 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.7 m -63.23 -32.09 73.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.56 178.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -68.73 -44.11 74.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.833 179.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.428 ' O ' HG23 ' A' ' 29' ' ' VAL . 22.9 ttm180 -68.09 -48.01 66.67 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 175.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -56.62 -44.58 81.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.108 -176.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -67.69 -39.29 84.44 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.959 -0.297 . . . . 0.0 110.598 -177.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.465 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 83.3 mtm180 -69.93 -40.4 75.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.66 -179.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.494 ' O ' HG23 ' A' ' 33' ' ' VAL . 84.6 t -62.49 -42.24 95.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 175.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.6 t -61.95 -42.36 99.03 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.49 178.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -61.37 -36.88 81.46 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 121.268 0.556 . . . . 0.0 110.472 177.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.433 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -73.34 -44.74 58.26 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.05 179.443 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 29' ' ' VAL . 78.2 t -60.81 -43.21 94.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.403 -179.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -68.23 -34.61 76.55 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.686 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -72.78 -43.59 62.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.657 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.762 ' HB2' HG11 ' A' ' 70' ' ' VAL . 94.8 mt -68.47 -32.16 71.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.111 0.481 . . . . 0.0 111.327 -178.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.9 mt -86.4 7.05 27.28 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.433 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.605 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 9.5 t70 -81.59 134.8 35.54 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.4 p -56.64 -32.9 65.79 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.696 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -68.13 -43.07 79.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.133 0.492 . . . . 0.0 110.571 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.418 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.5 t -78.04 -24.14 13.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.072 -175.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.605 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 83.9 mtt180 -60.97 -21.8 63.86 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.906 0.384 . . . . 0.0 110.358 173.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -85.69 -18.79 32.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.261 -177.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 p -88.32 155.81 51.48 Favored Pre-proline 0 C--N 1.328 -0.369 0 O-C-N 122.439 -0.163 . . . . 0.0 111.155 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.42 156.32 65.86 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.757 2.304 . . . . 0.0 112.04 176.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.443 HG21 ' HE3' ' A' ' 74' ' ' LYS . 2.2 m -60.06 -40.17 88.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.476 -176.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.6 m -58.55 -38.39 77.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.015 -177.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.1 m -65.55 -45.17 84.41 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.629 177.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.567 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 82.1 mttt -57.34 -48.59 78.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.058 178.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.509 HG12 HD21 ' A' ' 83' ' ' LEU . 57.9 t -63.84 -46.02 95.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.191 -177.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 17.0 m170 -64.53 -39.5 93.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.81 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -66.2 -42.72 88.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.097 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 67.3 mt -63.69 -34.76 78.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.804 178.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.532 ' HD3' HD22 ' A' ' 83' ' ' LEU . 33.8 ttpt -61.09 -44.36 97.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.805 0.336 . . . . 0.0 110.222 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.4 p -72.41 -12.98 61.34 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.515 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -81.98 1.35 35.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.859 0.361 . . . . 0.0 110.936 176.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 93.98 14.43 52.03 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.364 178.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.465 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 5.9 mp -91.49 147.99 22.62 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.013 0.435 . . . . 0.0 111.589 179.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.423 ' O ' HG13 ' A' ' 63' ' ' ILE . 1.9 m -92.72 173.25 7.86 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.006 173.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.87 -36.01 76.0 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.712 0.292 . . . . 0.0 111.087 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.7 mp0 -66.43 -45.23 80.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.919 -179.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -62.88 -43.32 99.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.523 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.426 HG23 HD12 ' A' ' 53' ' ' LEU . 78.2 mt -63.08 -45.12 99.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.649 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.5 t -57.78 -45.2 86.33 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.213 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.692 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 33.4 tt0 -67.35 -47.64 69.85 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.602 -178.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.545 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.89 -45.38 82.59 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.137 -178.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.574 ' O ' HG22 ' A' ' 70' ' ' VAL . 2.7 m-85 -57.98 -42.23 84.64 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.193 178.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.1 m -67.16 -33.29 75.1 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.177 0.513 . . . . 0.0 110.416 -177.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.692 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 20.1 mtpp -72.39 -29.79 64.07 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.986 -179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.762 HG11 ' HB2' ' A' ' 36' ' ' LEU . 10.8 m -83.75 0.27 4.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.854 0.359 . . . . 0.0 111.534 -178.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 96.13 18.33 31.84 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.42 178.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -127.46 91.15 46.7 Favored Pre-proline 0 C--N 1.323 -0.587 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -73.72 93.78 0.86 Allowed 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 121.992 1.795 . . . . 0.0 112.817 -175.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.443 ' HE3' HG21 ' A' ' 46' ' ' THR . 74.2 mmtt -103.65 137.46 41.67 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.482 175.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.452 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 70.0 p -77.47 162.92 26.8 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.263 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 44.3 tp -62.53 -32.63 73.6 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.119 -0.696 . . . . 0.0 109.119 175.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -60.35 -46.32 90.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.818 176.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.452 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 36.7 mm-40 -59.57 -45.88 90.55 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.09 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.419 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 39.4 mm -60.21 -46.78 94.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.524 -177.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -64.39 -39.52 94.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.932 0.396 . . . . 0.0 110.659 177.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.9 tpp180 -60.18 -46.55 89.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.393 177.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.5 mt -67.93 -31.99 54.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.202 -178.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.532 HD22 ' HD3' ' A' ' 54' ' ' LYS . 91.8 mt -82.64 -4.03 57.13 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.741 0.305 . . . . 0.0 111.358 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 45.5 m . . . . . 0 C--O 1.252 1.208 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.614 177.513 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt . . . . . 0 N--CA 1.482 1.125 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -68.84 149.92 73.13 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.372 2.048 . . . . 0.0 111.382 176.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -93.03 22.34 5.06 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.8 0.333 . . . . 0.0 111.409 -176.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 60.1 t -64.67 -43.76 96.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 176.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.427 ' OE1' ' HB2' ' A' ' 25' ' ' ARG . 44.7 mt-10 -122.6 103.56 8.77 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.868 174.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 22.2 p80 -118.52 4.66 11.72 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.927 0.394 . . . . 0.0 110.172 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.9 m -131.57 115.54 16.24 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.855 177.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 42.2 m-70 -64.92 -35.55 81.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.747 -176.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.4 t -63.66 -31.82 73.11 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.919 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.449 ' HA ' ' HE2' ' A' ' 27' ' ' LYS . 41.6 mt-10 -68.55 -40.39 80.67 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 121.061 -0.256 . . . . 0.0 110.647 -179.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.474 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 13.8 ttm180 -66.4 -46.63 75.96 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 174.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -55.96 -44.8 78.81 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.558 -175.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.449 ' HE2' ' HA ' ' A' ' 24' ' ' GLU . 60.4 pttt -68.92 -42.64 76.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.189 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.1 mtm-85 -70.47 -41.13 73.14 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 122.29 -0.256 . . . . 0.0 111.572 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.474 ' O ' HG23 ' A' ' 33' ' ' VAL . 75.2 t -66.01 -39.37 84.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 121.066 -0.253 . . . . 0.0 110.537 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.9 m -58.6 -40.59 83.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.71 0.29 . . . . 0.0 110.49 176.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.449 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 29.8 m-80 -66.55 -36.29 82.31 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.957 177.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.48 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -72.38 -45.22 60.76 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.441 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.58 HG13 HG12 ' A' ' 70' ' ' VAL . 78.2 t -61.36 -41.46 89.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.623 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 11.2 pt-20 -68.4 -33.64 74.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 0.0 110.658 178.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -71.88 -43.57 65.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.627 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.836 ' HB2' HG11 ' A' ' 70' ' ' VAL . 96.5 mt -67.75 -30.3 69.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.248 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.8 mt -85.82 4.24 38.01 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.018 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.549 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 18.4 t70 -75.04 132.81 41.58 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 177.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.5 m -53.66 -39.98 65.5 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 -174.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -69.17 -47.47 64.85 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.036 0.445 . . . . 0.0 110.327 178.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.3 t -66.65 -25.64 35.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.975 -177.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.549 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 83.0 mtp180 -65.52 -22.13 66.69 Favored 'General case' 0 C--N 1.319 -0.737 0 O-C-N 122.151 -0.343 . . . . 0.0 111.371 175.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 74.9 mtm180 -101.67 6.99 42.17 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -175.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.601 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -96.14 169.92 8.32 Favored Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 175.116 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.601 ' HD2' HG22 ' A' ' 44' ' ' THR . 57.2 Cg_endo -71.05 157.53 57.56 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.335 2.023 . . . . 0.0 111.906 175.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.478 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.3 OUTLIER -68.5 -39.83 81.12 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.524 -176.82 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.8 m -58.86 -35.8 73.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.521 -175.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.462 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 70.1 m -64.06 -44.82 91.29 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.221 0.534 . . . . 0.0 110.915 179.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.481 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 24.5 mttm -63.56 -45.47 90.37 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.502 -178.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 77.8 t -62.51 -44.62 99.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.57 -177.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 31.1 m170 -64.84 -38.24 90.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.401 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.491 ' O ' ' HG3' ' A' ' 56' ' ' LYS . 55.8 t80 -68.82 -43.37 75.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.725 -179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 76.8 mt -66.26 -38.7 88.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.756 0.312 . . . . 0.0 110.793 179.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -60.37 -40.6 91.42 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.242 0.544 . . . . 0.0 109.763 173.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.0 t -68.64 -20.03 64.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.244 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 52' ' ' PHE . 28.9 mtpp -81.5 -7.83 59.64 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.904 177.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.95 10.55 39.65 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.832 178.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.8 mp -82.31 145.13 30.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.276 0.56 . . . . 0.0 111.77 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.443 ' O ' HG13 ' A' ' 63' ' ' ILE . 8.6 m -85.42 164.82 17.66 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.123 175.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.33 -35.44 71.9 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.137 0.494 . . . . 0.0 110.404 178.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.403 ' HB3' HH22 ' A' ' 25' ' ' ARG . 62.4 mm-40 -62.79 -48.94 76.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.703 177.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.474 ' OE1' ' HA ' ' A' ' 25' ' ' ARG . 38.6 mt-10 -64.9 -44.49 89.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.242 -177.045 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 59' ' ' SER . 73.2 mt -59.77 -41.79 86.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.258 178.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.1 t -59.31 -44.52 92.55 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.609 178.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -68.3 -45.92 71.72 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.192 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.565 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.56 -45.32 81.31 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.515 -178.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.573 ' O ' HG22 ' A' ' 70' ' ' VAL . 7.6 m-85 -59.95 -45.05 93.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.107 0.479 . . . . 0.0 110.934 178.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.0 m -64.82 -33.13 75.26 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.622 -178.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.556 ' HE3' HG21 ' A' ' 33' ' ' VAL . 20.1 mtmt -71.77 -32.14 67.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.652 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.836 HG11 ' HB2' ' A' ' 36' ' ' LEU . 13.4 m -81.64 -3.83 7.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.714 0.292 . . . . 0.0 111.286 -177.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 100.01 18.21 22.97 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.298 179.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -126.6 90.94 48.59 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -73.63 97.18 0.95 Allowed 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 121.993 1.795 . . . . 0.0 112.748 -174.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.478 ' HE3' HG21 ' A' ' 46' ' ' THR . 74.3 mmtt -107.38 137.76 44.83 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.914 174.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.502 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 45.4 p -82.22 169.21 16.84 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.477 178.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.2 tp -62.9 -33.54 75.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.368 0.604 . . . . 0.0 109.811 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -60.27 -45.44 93.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.798 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.502 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 12.2 mm-40 -60.78 -47.15 87.63 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.052 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 42.6 mm -60.17 -46.15 94.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.805 -177.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 60.3 mttm -64.02 -40.06 95.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.363 . . . . 0.0 111.069 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -64.55 -43.61 93.4 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.74 178.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 72.7 mt -66.92 -31.73 54.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.618 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.9 mt -81.09 -6.85 59.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.482 177.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 14.4 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.433 -0.794 . . . . 0.0 109.746 177.175 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.6 mttm . . . . . 0 N--CA 1.481 1.093 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -73.4 162.43 40.21 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.64 2.227 . . . . 0.0 111.84 177.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.52 ' CD ' ' H ' ' A' ' 17' ' ' GLU . 0.3 OUTLIER -91.82 20.29 5.77 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.126 0.489 . . . . 0.0 111.011 -176.373 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 25.6 t -81.41 -19.26 11.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.814 -178.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -74.44 -37.51 63.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.951 0.405 . . . . 0.0 110.615 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -122.18 87.93 2.84 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 177.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.4 p -72.14 171.23 12.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.528 -175.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 72.8 m-70 -65.36 -42.91 92.27 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.868 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 32.6 t -64.37 -38.04 89.62 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.751 0.31 . . . . 0.0 110.249 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.536 ' O ' ' HG2' ' A' ' 27' ' ' LYS . 27.6 tt0 -65.55 -47.35 76.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.85 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.44 ' O ' HG23 ' A' ' 29' ' ' VAL . 20.7 ptp180 -69.53 -39.04 77.72 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.433 178.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -60.39 -44.46 95.65 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.405 -179.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 21.7 ptmt -66.43 -37.13 84.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.727 -177.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.572 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 82.7 mtm-85 -68.36 -44.23 75.68 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.862 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.57 ' O ' HG23 ' A' ' 33' ' ' VAL . 94.2 t -60.9 -41.94 90.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 110.027 -0.361 . . . . 0.0 110.027 177.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.0 t -60.64 -45.55 93.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.842 0.353 . . . . 0.0 110.404 178.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -62.86 -35.31 79.57 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.996 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.39 -44.73 64.4 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.152 179.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.578 HG13 HG12 ' A' ' 70' ' ' VAL . 87.4 t -60.98 -42.69 93.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.56 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -68.65 -35.18 76.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.839 179.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -71.76 -43.25 66.09 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-O 120.925 0.393 . . . . 0.0 110.791 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.762 ' HB2' HG11 ' A' ' 70' ' ' VAL . 87.1 mt -65.24 -30.68 71.58 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.329 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.449 ' HA ' HD23 ' A' ' 37' ' ' LEU . 13.0 mt -85.72 7.47 23.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.979 -178.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.48 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 13.5 t70 -78.99 138.06 37.87 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 176.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.0 m -57.09 -39.63 75.39 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -176.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -68.22 -37.09 80.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.059 0.457 . . . . 0.0 110.412 -179.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.552 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 70.7 t -75.13 -34.01 30.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.758 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.48 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 84.0 mtp180 -63.84 -21.14 66.3 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.03 0.443 . . . . 0.0 110.303 174.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -88.52 -17.49 30.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.026 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.5 p -85.52 159.7 55.18 Favored Pre-proline 0 C--N 1.329 -0.309 0 O-C-N 122.195 -0.316 . . . . 0.0 110.848 177.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.25 158.9 49.81 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.625 2.217 . . . . 0.0 112.021 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.472 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.3 OUTLIER -61.77 -39.6 92.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.541 -176.052 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.43 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 7.6 t -59.38 -43.1 92.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.765 -176.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.3 m -60.33 -42.89 96.57 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.021 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.552 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 79.9 mttt -60.26 -49.1 78.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.001 178.036 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.476 HG12 HD21 ' A' ' 83' ' ' LEU . 59.2 t -65.59 -44.26 93.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.809 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 22.5 m170 -63.9 -37.41 87.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.013 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -66.89 -44.36 81.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.463 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 89.0 mt -66.5 -41.15 89.31 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.887 -178.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.459 ' HD2' ' O ' ' A' ' 58' ' ' LEU . 42.4 tptt -62.84 -37.33 86.4 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.181 0.515 . . . . 0.0 109.926 176.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 35.5 t -70.98 -14.24 62.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.821 178.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 37.4 mtpt -91.46 2.1 56.66 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.998 0.428 . . . . 0.0 110.933 176.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.91 6.12 57.18 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.59 -0.814 . . . . 0.0 113.026 176.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.572 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.4 mp -73.19 153.0 40.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.201 0.524 . . . . 0.0 111.283 178.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.2 m -92.89 161.86 14.31 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.336 172.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.13 -42.61 86.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.798 0.332 . . . . 0.0 111.147 -177.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -62.16 -38.32 88.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.03 178.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.85 -41.98 86.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.048 0.451 . . . . 0.0 110.384 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.434 HG21 HG13 ' A' ' 50' ' ' VAL . 71.8 mt -63.6 -45.2 98.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.402 176.21 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 45.2 t -56.8 -42.6 79.79 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.016 178.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 57.3 tt0 -66.35 -48.42 70.28 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.659 178.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.521 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.72 -47.91 78.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.093 -178.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.617 ' O ' HG22 ' A' ' 70' ' ' VAL . 5.2 m-85 -55.29 -46.83 76.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.022 0.439 . . . . 0.0 111.308 178.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.4 m -65.48 -32.63 74.34 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.961 0.41 . . . . 0.0 110.697 -177.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.5 ' HE3' HG21 ' A' ' 33' ' ' VAL . 21.8 mtmt -72.12 -28.88 63.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.769 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.762 HG11 ' HB2' ' A' ' 36' ' ' LEU . 10.6 m -84.18 -1.21 6.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.08 0.467 . . . . 0.0 111.193 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.09 14.05 43.72 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.449 178.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -121.22 90.6 47.57 Favored Pre-proline 0 C--N 1.322 -0.615 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -70.87 105.2 1.62 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.012 1.808 . . . . 0.0 112.167 -175.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -116.35 138.39 51.37 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.791 176.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.1 p -82.03 159.28 23.51 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.34 179.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 55.4 tp -61.7 -32.85 73.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.287 0.565 . . . . 0.0 109.661 177.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -57.01 -46.38 82.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.018 177.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.428 ' O ' HG13 ' A' ' 82' ' ' ILE . 38.3 mt-10 -63.33 -46.94 84.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.527 179.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 46.9 mm -59.93 -44.39 94.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.919 -176.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -63.77 -43.09 97.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.058 0.456 . . . . 0.0 110.773 178.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -63.33 -44.72 94.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.979 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.43 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 96.4 mt -63.84 -36.64 77.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.101 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.476 HD21 HG12 ' A' ' 50' ' ' VAL . 75.5 mt -77.53 -25.39 50.19 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.289 -179.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 7.1 t . . . . . 0 C--O 1.254 1.3 0 CA-C-O 118.181 -0.914 . . . . 0.0 109.996 -179.107 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 93.3 mttt . . . . . 0 N--CA 1.48 1.031 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -82.99 158.39 15.56 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.572 2.181 . . . . 0.0 111.735 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -99.74 61.69 1.15 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.534 0.683 . . . . 0.0 110.661 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 42.9 t -77.66 -44.93 29.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.613 -178.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -71.53 146.52 48.44 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.389 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 -84.76 113.89 21.66 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.377 -177.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.8 p -75.65 110.25 9.9 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.034 176.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 64.2 m170 -62.63 -24.73 67.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.664 -177.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.1 p -61.4 -40.42 94.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.957 177.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.404 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 0.5 OUTLIER -60.87 -43.25 98.69 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.649 178.473 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.458 ' O ' HG23 ' A' ' 29' ' ' VAL . 40.8 ttt180 -67.82 -47.82 67.95 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.061 176.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -60.06 -43.7 95.22 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.742 -175.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -65.02 -38.07 89.7 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.015 -178.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.516 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 88.4 mtm-85 -69.46 -39.55 77.67 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.908 0.385 . . . . 0.0 110.204 177.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.643 ' O ' HG23 ' A' ' 33' ' ' VAL . 71.2 t -62.75 -43.57 98.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.109 174.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 45.3 m -58.0 -45.86 86.16 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.749 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -61.66 -37.64 84.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.092 0.472 . . . . 0.0 110.928 178.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.49 -44.38 62.34 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.46 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.643 HG23 ' O ' ' A' ' 29' ' ' VAL . 67.7 t -61.07 -43.3 95.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.023 0.44 . . . . 0.0 110.355 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -69.22 -35.96 76.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.794 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -72.32 -43.48 64.09 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.834 0.35 . . . . 0.0 110.994 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.619 ' HB2' HG11 ' A' ' 70' ' ' VAL . 75.0 mt -63.61 -31.1 72.16 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.491 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 37' ' ' LEU . 11.7 mt -85.89 6.99 25.83 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -178.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -77.07 139.38 39.99 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.717 -0.393 . . . . 0.0 109.989 177.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.564 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 14.5 m -57.89 -37.04 73.26 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.933 -175.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 33.4 mmt180 -69.57 -38.5 77.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.155 0.502 . . . . 0.0 110.587 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.582 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 58.2 t -74.5 -34.52 35.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.132 -176.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' ' 39' ' ' SER . 22.4 ptt180 -67.63 -21.37 65.39 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.877 0.37 . . . . 0.0 110.254 176.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -89.28 -7.11 56.1 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.686 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.4 p -96.96 158.4 33.46 Favored Pre-proline 0 C--N 1.326 -0.451 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.012 176.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -62.46 154.88 61.31 Favored 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.703 2.268 . . . . 0.0 111.95 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.446 ' O ' HG23 ' A' ' 50' ' ' VAL . 1.3 m -60.27 -35.63 75.96 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.859 -178.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.3 m -58.24 -42.87 87.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.786 -178.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.2 m -63.25 -45.74 90.15 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.873 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.582 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 82.2 mttt -57.46 -49.99 74.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.179 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 46' ' ' THR . 80.9 t -64.23 -43.54 97.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.925 -176.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 26.2 m170 -64.56 -37.48 87.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.081 -178.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -69.68 -42.68 73.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.387 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 68.7 mt -64.46 -39.26 93.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.674 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.44 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 29.8 tptt -63.87 -39.93 95.36 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 120.967 0.413 . . . . 0.0 110.102 176.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.2 t -69.63 -14.35 62.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.713 178.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -83.86 -1.61 54.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.793 176.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.42 17.92 47.72 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.627 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.516 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.4 mp -83.03 159.0 22.27 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.265 0.555 . . . . 0.0 111.043 177.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.1 m -100.59 165.23 11.51 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.438 -0.801 . . . . 0.0 108.897 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.95 -34.51 69.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.906 0.384 . . . . 0.0 110.821 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.97 -49.62 76.95 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.905 177.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -63.67 -43.64 96.12 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.902 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 78.5 mt -60.84 -44.96 98.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.715 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.6 t -60.81 -43.39 98.25 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.7 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.44 ' CD ' HH21 ' A' ' 25' ' ' ARG . 27.5 tt0 -68.85 -48.54 63.22 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.123 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.79 -41.57 82.39 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 120.726 0.298 . . . . 0.0 111.551 -178.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.403 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.1 m-85 -60.93 -45.43 94.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.578 176.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 20.8 m -64.85 -34.33 78.11 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.043 0.449 . . . . 0.0 110.292 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.0 mmmt -63.14 -32.5 73.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.962 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.619 HG11 ' HB2' ' A' ' 36' ' ' LEU . 24.1 m -91.95 8.1 4.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.97 0.414 . . . . 0.0 111.401 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.41 23.7 33.34 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.794 177.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -126.61 91.31 47.71 Favored Pre-proline 0 C--N 1.32 -0.682 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 176.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -72.09 102.92 1.41 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 121.899 1.732 . . . . 0.0 111.744 -178.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -108.93 139.35 43.91 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.657 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 38.1 p -80.49 156.64 26.45 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.183 178.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 38.9 tp -63.25 -32.69 74.16 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.126 0.488 . . . . 0.0 109.943 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -60.36 -45.17 94.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.723 177.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -59.04 -47.58 84.72 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.511 177.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.0 mm -59.8 -45.19 95.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.433 -178.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.2 -44.99 93.79 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.868 0.366 . . . . 0.0 110.874 177.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.3 tpp180 -61.65 -47.22 86.38 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.943 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 86.3 mt -64.6 -34.45 69.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.765 -179.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 80.8 mt -81.61 -4.3 55.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.794 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 38.4 m . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.836 -0.602 . . . . 0.0 110.282 176.004 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 120.761 0.315 . . . . 0.0 110.339 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.73 145.88 20.63 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.548 2.165 . . . . 0.0 111.614 176.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -90.6 91.28 8.35 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.103 0.478 . . . . 0.0 110.302 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 45.9 t -116.78 -59.25 3.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.467 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -69.91 148.4 49.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.392 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 23.8 m-70 63.07 166.55 0.13 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.872 -174.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.4 m 62.7 -75.92 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 122.744 0.417 . . . . 0.0 111.159 -178.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 68.0 m80 -66.15 -45.39 81.14 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.4 t -67.67 -37.89 83.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.377 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -68.1 -40.28 82.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.682 -178.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 41.6 ttt180 -68.11 -47.85 67.04 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 120.732 0.301 . . . . 0.0 110.255 175.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -57.64 -44.02 85.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.642 -175.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -67.6 -40.27 84.75 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.969 -178.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 51.6 mtm-85 -69.74 -40.23 76.3 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.52 0.2 . . . . 0.0 111.138 -177.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.652 ' O ' HG23 ' A' ' 33' ' ' VAL . 81.6 t -60.57 -43.7 95.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 175.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.3 m -62.16 -38.23 88.25 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.198 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.44 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 95.1 m-20 -61.79 -37.13 83.21 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.25 0.547 . . . . 0.0 110.382 177.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.05 -44.92 52.54 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.211 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.652 HG23 ' O ' ' A' ' 29' ' ' VAL . 61.8 t -61.58 -39.94 84.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.832 0.349 . . . . 0.0 110.544 -178.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 12.7 pt-20 -68.72 -38.46 80.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.91 178.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -72.38 -43.28 64.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.821 0.343 . . . . 0.0 110.935 -179.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.665 ' HB2' HG11 ' A' ' 70' ' ' VAL . 88.7 mt -66.15 -31.15 71.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.595 -177.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.518 ' HG ' HG12 ' A' ' 70' ' ' VAL . 11.3 mt -86.03 4.62 37.12 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -177.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.552 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 12.4 t70 -75.46 138.18 41.45 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.233 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.2 t -53.95 -37.71 64.17 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.389 -178.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 73.2 mtm180 -68.54 -46.52 69.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.393 0.616 . . . . 0.0 110.414 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.444 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.2 t -71.41 -29.46 35.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.209 -174.04 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.552 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 78.6 mtp180 -65.38 -21.96 66.74 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.213 177.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 25.2 mtm180 -90.12 -17.09 28.3 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.646 0.239 . . . . 0.0 111.646 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.3 p -83.64 159.17 61.59 Favored Pre-proline 0 C--N 1.326 -0.42 0 C-N-CA 121.238 -0.185 . . . . 0.0 110.89 177.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.45 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 35.8 Cg_endo -65.09 159.45 46.63 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.659 2.24 . . . . 0.0 112.512 177.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.415 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.7 OUTLIER -61.76 -39.73 92.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.22 -177.749 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 5.9 m -58.26 -40.96 83.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.278 -177.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 63.7 m -62.97 -46.64 86.76 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.736 177.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.542 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 80.7 mttt -56.99 -49.01 77.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.313 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 46' ' ' THR . 91.2 t -64.2 -45.02 97.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.268 -176.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 17.8 m170 -64.84 -38.93 92.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.017 -178.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -64.14 -42.93 96.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.277 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 87.7 mt -65.71 -37.97 87.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.848 -179.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -60.84 -42.24 97.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.005 174.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.4 t -69.59 -13.67 62.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.631 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.8 mmpt? -85.6 -3.04 58.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.626 175.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.1 17.37 40.68 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.637 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.2 mp -88.38 152.53 21.85 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.397 0.618 . . . . 0.0 111.934 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.2 m -93.52 164.91 13.0 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.743 175.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.23 -37.46 74.9 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.897 0.379 . . . . 0.0 110.839 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.443 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 1.6 mp0 -62.44 -46.87 86.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.42 178.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -65.63 -40.5 92.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.621 -177.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.4 HG23 HD12 ' A' ' 53' ' ' LEU . 87.8 mt -64.64 -45.8 94.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.608 177.124 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 31.3 t -56.68 -44.76 81.78 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.165 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -68.27 -45.86 71.97 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.066 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 69' ' ' LYS . . . -57.76 -40.76 80.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.737 0.303 . . . . 0.0 111.473 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.416 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.2 m-85 -60.04 -45.41 92.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.654 176.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.3 m -65.32 -33.08 75.13 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.229 0.538 . . . . 0.0 109.803 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 66' ' ' ALA . 27.0 mmmt -62.06 -35.77 79.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.937 177.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.665 HG11 ' HB2' ' A' ' 36' ' ' LEU . 22.1 m -89.89 5.37 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.822 0.344 . . . . 0.0 111.577 -176.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 94.66 13.5 53.31 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.875 176.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -119.42 90.81 43.21 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -72.43 102.31 1.37 Allowed 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 121.849 1.699 . . . . 0.0 112.053 -178.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -111.21 138.42 47.67 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.837 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 32.9 p -76.74 158.9 30.61 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.516 178.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 49.5 tp -62.99 -32.96 74.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.146 0.498 . . . . 0.0 109.947 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -58.72 -45.29 89.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.758 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.2 mm-40 -59.14 -48.76 80.43 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.521 178.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.7 mm -60.51 -44.19 95.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.678 -177.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -63.14 -44.04 96.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.932 177.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -60.99 -43.0 99.47 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.109 178.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 77.0 mt -66.68 -36.58 77.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.942 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 83.6 mt -77.74 -24.66 48.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.403 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 51.8 p . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.613 -0.708 . . . . 0.0 110.317 179.378 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.6 pttp . . . . . 0 N--CA 1.477 0.922 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.15 128.61 16.85 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.447 2.098 . . . . 0.0 111.989 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -95.56 93.87 7.43 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.288 0.565 . . . . 0.0 110.225 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.5 t -93.84 -56.93 4.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.749 178.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -100.88 -173.79 2.47 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.22 176.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 40.0 m80 -80.3 -43.91 20.48 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.601 -0.439 . . . . 0.0 110.745 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.533 HG23 ' H ' ' A' ' 24' ' ' GLU . 9.9 t -170.57 162.25 7.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.762 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -61.26 -34.4 75.1 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.491 176.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.8 t -61.92 -30.12 70.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.975 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.553 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 34.0 tt0 -71.55 -47.74 53.14 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.429 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -66.08 -36.72 83.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -62.92 -45.92 90.25 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.242 178.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 64.1 pttt -70.8 -32.23 69.25 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.9 -177.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.553 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 29.0 mtm180 -62.52 -47.36 84.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.799 0.333 . . . . 0.0 110.379 178.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.516 ' O ' HG23 ' A' ' 33' ' ' VAL . 75.6 t -65.0 -39.89 87.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.075 177.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.0 m -58.04 -46.57 85.13 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.775 177.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -63.02 -36.47 83.68 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.172 178.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.405 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -71.68 -44.92 63.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.05 -179.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.516 HG23 ' O ' ' A' ' 29' ' ' VAL . 82.2 t -61.18 -43.13 95.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.55 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -68.36 -35.53 77.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.9 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -72.43 -43.76 63.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.813 0.34 . . . . 0.0 110.677 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.68 ' HB2' HG11 ' A' ' 70' ' ' VAL . 86.6 mt -64.8 -29.95 70.94 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.563 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 37' ' ' LEU . 19.6 mt -85.04 7.69 20.54 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.088 -176.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.658 ' OD2' ' HG2' ' A' ' 40' ' ' ARG . 9.4 t70 -85.37 139.06 31.86 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.104 177.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.649 ' O ' ' HG3' ' A' ' 43' ' ' ARG . 27.1 t -55.52 -41.15 72.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.238 -178.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.658 ' HG2' ' OD2' ' A' ' 38' ' ' ASP . 11.0 ptm180 -67.81 -32.56 73.21 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.035 0.445 . . . . 0.0 110.646 -177.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.567 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 98.8 t -78.98 -33.18 15.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.444 -178.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 82.7 mtp180 -66.56 -22.04 66.15 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.909 175.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.649 ' HG3' ' O ' ' A' ' 39' ' ' SER . 67.9 mtt180 -86.15 -18.32 32.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.464 -178.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.08 158.73 58.15 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 121.187 -0.205 . . . . 0.0 110.822 177.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.37 154.02 73.66 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.381 2.054 . . . . 0.0 112.015 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -34.43 73.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.952 -177.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.6 p -58.54 -43.1 89.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.843 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 62.0 m -64.78 -44.67 89.24 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.124 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.567 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 82.9 mttt -56.98 -49.38 75.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.078 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 62.3 t -67.73 -43.62 86.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.009 -176.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 25.2 m170 -65.04 -36.68 85.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.595 -177.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.45 ' O ' ' HG3' ' A' ' 56' ' ' LYS . 72.6 t80 -69.94 -45.45 67.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.45 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 98.9 mt -62.87 -40.84 98.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.075 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.423 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 46.5 tptt -62.96 -40.0 96.36 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.427 177.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.3 t -70.79 -13.78 62.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.637 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' A' ' 52' ' ' PHE . 39.4 mtpt -86.12 -2.8 58.67 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.189 177.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 102.04 9.22 42.98 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.886 177.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.472 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.9 mp -80.6 156.01 26.62 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.44 0.638 . . . . 0.0 111.62 178.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.422 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 20.1 m -98.71 168.89 9.86 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.538 174.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.18 95.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.686 0.279 . . . . 0.0 111.113 -177.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -60.53 -40.85 93.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.938 177.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.422 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 6.3 mm-40 -63.1 -47.97 80.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.961 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 61.9 mt -64.65 -45.41 95.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.72 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.6 t -56.98 -45.02 83.25 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.946 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -67.76 -47.02 70.42 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.909 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.552 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -57.19 -47.26 81.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.052 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.578 ' O ' HG22 ' A' ' 70' ' ' VAL . 2.7 m-85 -56.44 -44.23 80.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.105 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.1 m -66.15 -33.54 76.01 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.807 0.337 . . . . 0.0 110.65 -177.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.492 ' HE3' HG21 ' A' ' 33' ' ' VAL . 22.4 mtmt -70.91 -30.95 67.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.795 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.68 HG11 ' HB2' ' A' ' 36' ' ' LEU . 7.9 m -83.47 -0.83 5.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.848 0.356 . . . . 0.0 111.287 -177.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 96.28 19.87 26.91 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.483 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -127.81 91.3 45.57 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 177.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.84 101.14 1.15 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 121.892 1.728 . . . . 0.0 112.57 -175.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -109.46 139.35 44.55 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.044 176.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 34.7 p -82.45 164.55 20.89 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.113 176.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.1 tp -63.08 -32.73 74.18 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 176.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -59.52 -45.62 91.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.475 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -58.69 -46.94 86.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.216 178.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 41.6 mm -61.59 -45.36 98.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.786 -177.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -64.14 -39.53 94.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.998 0.428 . . . . 0.0 110.479 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -59.89 -48.63 80.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.898 177.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.3 mt -69.85 -33.37 55.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.828 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 75.5 mt -82.97 1.64 38.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.745 0.307 . . . . 0.0 111.598 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 26.2 t . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.577 -0.725 . . . . 0.0 109.264 176.026 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.443 ' HD3' ' O ' ' A' ' 15' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 120.603 0.24 . . . . 0.0 110.55 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.405 ' HB2' HG12 ' A' ' 18' ' ' VAL . 73.4 Cg_endo -76.25 155.94 37.36 Favored 'Trans proline' 0 N--CA 1.461 -0.396 0 C-N-CA 122.899 2.399 . . . . 0.0 112.452 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -96.05 12.33 30.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.595 0.712 . . . . 0.0 110.096 176.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.405 HG12 ' HB2' ' A' ' 16' ' ' PRO . 2.9 p -109.95 115.59 50.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.059 178.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -137.86 147.45 44.5 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.561 -178.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -102.64 -59.76 1.65 Allowed 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 174.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.1 m -83.08 88.29 6.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.386 -178.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.42 ' O ' ' HG2' ' A' ' 25' ' ' ARG . 87.0 m-70 -73.12 -27.07 61.48 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.915 -178.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 32.2 t -62.33 -29.69 70.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.737 178.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.516 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 43.0 tt0 -65.82 -47.39 75.22 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.971 -0.291 . . . . 0.0 110.531 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.42 ' HG2' ' O ' ' A' ' 22' ' ' HIS . 29.0 ptt180 -68.43 -36.87 79.67 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.465 -0.494 . . . . 0.0 109.888 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -64.43 -43.94 92.73 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.944 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 63.6 pttt -67.27 -32.53 73.61 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.387 -179.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.516 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 21.2 mtm180 -65.46 -45.52 83.42 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.645 ' O ' HG23 ' A' ' 33' ' ' VAL . 73.3 t -60.63 -46.39 95.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.843 175.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.1 t -59.68 -42.83 93.82 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.171 -179.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -61.83 -36.85 82.39 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.051 0.453 . . . . 0.0 110.632 177.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.447 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -72.28 -41.86 66.21 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.878 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 29' ' ' VAL . 93.6 t -61.0 -46.55 96.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 120.869 0.366 . . . . 0.0 110.246 179.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -68.75 -33.65 74.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.815 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -71.42 -43.59 66.48 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.056 0.455 . . . . 0.0 110.615 179.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.635 ' HB2' HG11 ' A' ' 70' ' ' VAL . 93.2 mt -66.81 -32.24 73.4 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.884 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.2 mt -88.69 6.31 39.09 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -77.24 138.18 39.26 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.519 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 48.7 m -59.81 -33.93 72.39 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 -176.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.529 ' HG2' HG23 ' A' ' 41' ' ' VAL . 7.5 ptp180 -70.63 -40.58 73.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.069 0.461 . . . . 0.0 110.142 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.529 HG23 ' HG2' ' A' ' 40' ' ' ARG . 47.6 t -80.32 -26.96 11.7 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.856 -173.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.519 ' HG2' ' O ' ' A' ' 39' ' ' SER . 37.5 ptt180 -64.37 -20.29 66.03 Favored 'General case' 0 C--N 1.318 -0.799 0 O-C-N 121.738 -0.601 . . . . 0.0 111.222 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -83.43 -17.77 40.99 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -176.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.519 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -85.98 169.84 14.46 Favored Pre-proline 0 CA--C 1.536 0.442 0 O-C-N 122.44 -0.163 . . . . 0.0 111.348 -176.118 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.519 ' HD2' HG22 ' A' ' 44' ' ' THR . 44.2 Cg_endo -69.14 162.88 39.94 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.467 2.111 . . . . 0.0 112.191 174.455 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.46 -45.01 73.59 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.834 -176.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.1 m -58.44 -38.01 76.6 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.95 -174.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.8 m -60.27 -42.86 96.3 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 121.114 0.483 . . . . 0.0 110.873 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.493 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 25.3 mttm -63.71 -45.0 91.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.516 -178.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 60.3 t -63.17 -43.25 98.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.653 -178.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -64.59 -37.62 88.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.658 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -67.27 -46.27 74.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.531 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 96.2 mt -61.86 -39.62 92.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.746 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 51.1 tptt -59.87 -42.81 94.53 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.518 175.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.0 t -70.97 -19.32 62.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.841 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 55.3 mmtt -82.04 -3.56 54.86 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.989 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 102.14 9.0 43.29 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.566 -0.826 . . . . 0.0 112.824 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.493 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.4 mp -82.55 149.36 27.54 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.381 0.61 . . . . 0.0 111.315 179.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.417 ' H ' ' HG3' ' A' ' 62' ' ' GLU . 39.6 m -94.18 169.58 10.14 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.559 174.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.1 -37.78 77.96 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.861 0.363 . . . . 0.0 110.875 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.21 -44.85 92.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.401 177.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.421 ' H ' ' HG2' ' A' ' 62' ' ' GLU . 4.5 mm-40 -63.17 -48.29 79.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.877 -178.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 61.3 mt -63.38 -43.54 98.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.946 -178.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 52.6 t -57.51 -44.1 84.75 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.848 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -68.57 -48.46 64.17 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.905 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.18 -41.11 78.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.883 -178.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.424 ' O ' HG22 ' A' ' 70' ' ' VAL . 6.6 m-85 -61.26 -45.9 92.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.849 0.357 . . . . 0.0 110.635 177.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.5 m -63.08 -35.35 79.95 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.105 0.479 . . . . 0.0 110.125 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.409 ' HB2' HG22 ' A' ' 33' ' ' VAL . 29.0 mmtt -60.93 -36.46 79.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.45 178.344 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.635 HG11 ' HB2' ' A' ' 36' ' ' LEU . 18.6 m -90.6 9.59 3.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.543 -175.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.62 16.07 57.32 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.799 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.404 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 6.5 tp-100 -121.75 90.64 48.39 Favored Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 177.344 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.07 95.86 0.85 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 121.955 1.77 . . . . 0.0 112.588 -176.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -103.63 137.72 41.29 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.678 175.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 41.7 p -77.68 161.72 27.56 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.136 177.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.454 ' HG ' ' HE3' ' A' ' 80' ' ' LYS . 62.6 tp -61.65 -32.94 73.13 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -60.34 -44.25 95.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.997 176.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -57.45 -49.13 77.25 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.088 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 41.1 mm -60.77 -41.83 89.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.449 -177.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.454 ' HE3' ' HG ' ' A' ' 76' ' ' LEU . 96.1 mttt -61.18 -44.08 97.87 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.151 177.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.0 tpp180 -62.58 -46.14 89.7 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.598 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 83.9 mt -65.3 -36.56 78.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.131 -178.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 72.2 mt -80.91 -4.57 55.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.617 0.246 . . . . 0.0 111.638 178.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 19.9 t . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.732 -0.652 . . . . 0.0 109.629 178.033 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.6 mttt . . . . . 0 N--CA 1.479 1.011 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -80.56 122.43 4.5 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 122.685 2.256 . . . . 0.0 112.155 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -85.19 87.61 7.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.305 0.574 . . . . 0.0 110.238 -178.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 21.2 t -115.67 -23.06 4.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.5 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -72.16 109.53 6.0 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.896 -178.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 33.2 m80 65.08 84.13 0.16 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.197 -178.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 31.4 m -109.56 -67.81 0.96 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.354 177.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -73.3 -34.02 65.5 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.705 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.8 p -56.87 -37.25 71.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.219 -178.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.483 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 8.2 mm-40 -69.29 -46.73 66.48 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.987 -175.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.437 ' O ' HG23 ' A' ' 29' ' ' VAL . 7.3 ptm180 -69.73 -37.32 76.48 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.284 -0.566 . . . . 0.0 109.929 176.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -62.94 -43.6 98.34 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.364 -177.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -65.16 -35.02 79.78 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.259 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 21.2 mtm180 -70.04 -41.55 74.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.344 178.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.464 ' O ' HG23 ' A' ' 33' ' ' VAL . 69.3 t -61.1 -44.52 98.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.09 174.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.3 m -60.84 -43.29 98.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.837 178.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -61.75 -35.84 79.28 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.068 0.461 . . . . 0.0 110.681 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.48 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -72.07 -44.8 62.74 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.953 178.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.564 HG13 HG12 ' A' ' 70' ' ' VAL . 67.7 t -60.98 -43.42 96.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.684 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -67.88 -35.9 79.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.67 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -72.26 -43.7 63.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.902 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.688 ' HB2' HG11 ' A' ' 70' ' ' VAL . 93.1 mt -65.12 -31.35 72.5 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.453 -178.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.402 ' HA ' HD23 ' A' ' 37' ' ' LEU . 11.8 mt -85.79 -0.68 55.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.222 -0.444 . . . . 0.0 112.086 -176.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -69.26 138.18 53.71 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.402 ' HA ' ' HG2' ' A' ' 42' ' ' ARG . 11.8 m -63.05 -30.5 71.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.843 0.354 . . . . 0.0 111.526 -175.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -69.34 -38.3 78.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.365 0.603 . . . . 0.0 110.39 175.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.7 t -79.24 -36.35 18.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.251 -172.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.402 ' HG2' ' HA ' ' A' ' 39' ' ' SER . 17.2 ptp180 -62.13 -20.28 63.91 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 120.859 0.361 . . . . 0.0 110.796 176.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 43' ' ' ARG . 40.7 ttm180 -85.21 -18.92 32.59 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.586 -178.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.602 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -89.13 168.38 15.54 Favored Pre-proline 0 CA--C 1.536 0.405 0 CA-C-N 116.85 -0.159 . . . . 0.0 110.989 -177.657 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.602 ' HD2' HG22 ' A' ' 44' ' ' THR . 49.2 Cg_endo -68.18 156.88 64.13 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.695 2.264 . . . . 0.0 111.975 176.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.451 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -68.12 -33.97 75.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.065 -177.491 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.531 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 20.6 m -58.28 -40.75 82.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.518 -177.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 54.7 m -59.84 -48.02 83.36 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.089 178.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.483 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 2.2 mttp -58.17 -48.8 79.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.21 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 58.3 t -64.02 -41.58 92.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.747 -175.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -65.12 -39.28 92.85 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.368 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -65.18 -48.81 72.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.48 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 85.0 mt -62.68 -39.56 94.32 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.045 -177.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -60.51 -42.83 97.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.021 0.439 . . . . 0.0 110.236 175.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 45.7 m -68.77 -19.71 64.32 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.827 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -80.83 -8.22 59.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.732 176.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.52 8.32 37.99 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.826 177.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.408 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 5.5 mp -80.07 144.72 32.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.252 0.549 . . . . 0.0 111.842 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.425 ' O ' HG13 ' A' ' 63' ' ' ILE . 6.1 m -86.46 165.42 16.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.37 174.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.25 -38.8 84.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.994 0.426 . . . . 0.0 110.929 -178.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -65.49 -37.55 87.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.909 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -67.1 -48.05 69.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.54 177.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.429 HG23 HD12 ' A' ' 53' ' ' LEU . 73.7 mt -59.31 -44.89 93.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.537 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.4 t -56.61 -43.35 80.07 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.788 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.704 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 32.5 tt0 -67.93 -48.31 66.3 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.925 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.484 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.25 -43.77 79.02 Favored 'General case' 0 CA--C 1.519 -0.24 0 O-C-N 123.147 0.279 . . . . 0.0 110.965 -178.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.562 ' O ' HG22 ' A' ' 70' ' ' VAL . 7.0 m-85 -58.57 -43.88 89.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.944 0.402 . . . . 0.0 110.954 177.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.8 m -65.96 -33.13 75.11 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.112 0.482 . . . . 0.0 110.618 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.704 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 25.2 mtpp -72.33 -30.35 64.68 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.91 -179.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.688 HG11 ' HB2' ' A' ' 36' ' ' LEU . 14.4 m -84.2 1.66 4.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.939 0.4 . . . . 0.0 111.201 -179.132 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.07 12.88 47.94 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.561 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -121.53 90.72 48.12 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.73 103.48 1.46 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 121.776 1.65 . . . . 0.0 112.001 -176.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.451 ' HE3' HG21 ' A' ' 46' ' ' THR . 71.3 mmtt -111.87 138.28 48.69 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.004 177.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 50.9 p -80.09 167.8 19.95 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.047 176.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.4 tp -63.56 -32.66 74.19 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -59.22 -45.46 91.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.832 176.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -56.31 -49.08 75.33 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.33 179.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 39.7 mm -63.45 -48.8 85.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.835 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -64.37 -39.63 94.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.41 -178.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -64.97 -44.69 88.54 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.116 0.484 . . . . 0.0 110.634 178.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.531 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 97.4 mt -65.48 -32.49 58.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.985 178.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 71.2 mt -79.36 -8.79 59.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.19 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 15.3 t . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.491 -0.766 . . . . 0.0 109.566 178.513 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 24.2 pttm . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 120.706 0.288 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.82 160.27 37.62 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.435 2.09 . . . . 0.0 111.535 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -97.83 9.31 42.99 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.933 0.397 . . . . 0.0 110.659 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 43.8 t -72.65 93.2 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 62.88 6.03 2.02 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.107 -172.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 60.3 -171.55 0.13 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 123.402 0.681 . . . . 0.0 111.542 178.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 40.8 m -69.29 109.03 3.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.121 0.486 . . . . 0.0 110.379 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -63.07 -41.33 99.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.599 -175.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.3 m -59.81 -35.54 74.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.356 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 27' ' ' LYS . 36.6 tt0 -70.11 -46.58 64.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.692 0.282 . . . . 0.0 110.821 -178.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.626 ' HB2' ' OE2' ' A' ' 62' ' ' GLU . 0.3 OUTLIER -68.07 -36.14 79.35 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.2 -0.6 . . . . 0.0 109.685 179.57 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -58.08 -44.19 87.43 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.986 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 64.7 pttt -71.91 -33.26 68.16 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.621 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.476 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 53.2 mtm180 -65.47 -48.0 74.17 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.705 0.288 . . . . 0.0 110.482 177.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.533 ' O ' HG23 ' A' ' 33' ' ' VAL . 76.5 t -61.74 -42.96 96.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.171 177.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.7 m -58.89 -45.66 89.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.908 178.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -62.0 -36.86 82.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.995 0.426 . . . . 0.0 111.135 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.75 -45.37 61.92 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.969 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 29' ' ' VAL . 90.6 t -61.22 -42.75 94.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.616 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.42 -35.82 76.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.168 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -71.21 -43.23 67.76 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.948 0.404 . . . . 0.0 110.553 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.721 ' HB2' HG11 ' A' ' 70' ' ' VAL . 88.9 mt -65.34 -29.19 69.89 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.284 179.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 37' ' ' LEU . 13.8 mt -85.67 6.35 27.98 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.693 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 13.4 t70 -79.72 133.56 36.35 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.661 -0.415 . . . . 0.0 109.939 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.5 m -52.96 -38.96 62.58 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 123.495 0.497 . . . . 0.0 112.044 -175.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -69.61 -36.68 76.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.128 0.49 . . . . 0.0 110.742 -179.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.526 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 61.5 t -76.8 -21.81 14.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.464 0.649 . . . . 0.0 110.385 -178.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.693 ' HG2' ' O ' ' A' ' 38' ' ' ASP . 20.4 mmm180 -64.08 -25.81 68.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.256 173.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -91.64 -17.98 24.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.542 -173.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.4 p -82.71 158.41 65.49 Favored Pre-proline 0 C--N 1.326 -0.447 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.123 -177.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -65.5 153.96 75.84 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.444 2.096 . . . . 0.0 111.754 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.57 -37.62 78.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.196 -177.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.513 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 18.9 m -58.76 -41.3 86.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.379 -177.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.6 m -63.57 -44.6 93.63 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.851 178.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.526 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 81.5 mttt -58.12 -48.26 80.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.398 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.451 HG12 HD21 ' A' ' 83' ' ' LEU . 85.2 t -66.96 -45.08 88.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.427 -176.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -64.38 -35.81 82.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.784 -177.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -67.14 -46.1 75.12 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.389 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 94.7 mt -64.25 -37.88 89.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.784 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.62 ' HD3' HD22 ' A' ' 83' ' ' LEU . 29.6 ttpt -63.26 -39.31 94.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.02 0.438 . . . . 0.0 109.94 176.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 44.3 m -68.71 -15.77 63.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.91 179.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -85.24 -4.08 59.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.613 175.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.09 1.68 55.94 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.854 -0.688 . . . . 0.0 112.694 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.476 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.4 mp -71.67 148.55 46.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.099 0.476 . . . . 0.0 111.364 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.464 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 9.4 m -90.79 165.98 13.36 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.286 175.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.86 -39.55 78.04 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.677 0.275 . . . . 0.0 111.683 -177.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -67.76 -35.07 78.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.39 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.626 ' OE2' ' HB2' ' A' ' 25' ' ' ARG . 4.1 mm-40 -64.96 -45.2 86.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.473 0.654 . . . . 0.0 109.48 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 67.8 mt -62.81 -42.1 95.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.291 177.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 32.1 t -56.8 -46.64 81.46 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.343 177.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -67.67 -48.13 67.5 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.712 -178.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.546 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.81 -45.76 82.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.295 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.549 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.1 m-85 -57.49 -45.1 85.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.898 0.38 . . . . 0.0 111.241 178.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.3 m -65.14 -33.23 75.52 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.94 0.4 . . . . 0.0 110.431 -177.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.514 ' HE3' HG21 ' A' ' 33' ' ' VAL . 21.3 mtmt -72.1 -27.73 62.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.607 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.721 HG11 ' HB2' ' A' ' 36' ' ' LEU . 8.4 m -88.79 7.49 3.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.736 0.303 . . . . 0.0 111.657 -179.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 93.05 17.21 44.48 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.743 176.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -127.22 91.08 47.38 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -68.19 105.72 1.25 Allowed 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 122.006 1.804 . . . . 0.0 112.195 -176.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -116.41 139.12 50.77 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.836 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 21.6 p -87.46 167.59 13.85 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.302 176.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 51.6 tp -63.63 -33.35 75.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.19 0.519 . . . . 0.0 109.676 176.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -57.77 -45.73 85.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.692 177.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -57.73 -48.36 79.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.994 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 36.5 mm -63.72 -46.02 95.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.813 -175.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -60.96 -43.05 99.31 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.07 0.462 . . . . 0.0 110.298 177.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.5 tpp180 -60.05 -45.12 93.89 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.434 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.513 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 86.9 mt -67.39 -35.07 72.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.964 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.62 HD22 ' HD3' ' A' ' 54' ' ' LYS . 84.3 mt -82.1 -0.18 43.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.382 179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 50.7 m . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.581 -0.723 . . . . 0.0 110.131 175.71 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.2 mttm . . . . . 0 N--CA 1.477 0.883 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -89.3 37.72 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.988 2.459 . . . . 0.0 112.457 179.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -110.98 16.68 21.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.939 0.399 . . . . 0.0 111.175 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 45.5 t -75.59 -35.52 31.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 173.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.423 ' HB3' ' NH1' ' A' ' 25' ' ' ARG . 7.4 pt-20 -83.22 78.71 9.57 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.46 -1.245 . . . . 0.0 109.737 173.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -79.73 -33.2 41.02 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.689 -175.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.624 ' HB ' ' OE2' ' A' ' 24' ' ' GLU . 12.2 p -126.1 98.47 5.5 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.341 0.591 . . . . 0.0 111.159 -176.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -70.07 -43.9 70.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.071 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.9 m -64.12 -38.64 91.79 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.864 -178.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.624 ' OE2' ' HB ' ' A' ' 21' ' ' THR . 10.9 mp0 -65.6 -44.82 85.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.532 177.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.423 ' NH1' ' HB3' ' A' ' 19' ' ' GLU . 27.3 ttm180 -63.45 -43.1 98.37 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.99 0.424 . . . . 0.0 110.231 176.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -59.21 -44.49 92.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.375 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.568 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 22.2 ptmt -69.76 -38.27 76.71 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.929 -0.308 . . . . 0.0 110.633 -177.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.579 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 60.2 mtm180 -63.84 -45.36 89.86 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.704 0.287 . . . . 0.0 110.626 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.487 ' O ' HG23 ' A' ' 33' ' ' VAL . 85.0 t -64.31 -41.44 92.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.415 177.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.4 m -62.08 -42.98 99.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.247 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -61.91 -35.65 79.0 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.172 0.51 . . . . 0.0 110.652 176.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.35 -44.91 61.93 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.243 179.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.493 HG13 HG12 ' A' ' 70' ' ' VAL . 71.5 t -60.87 -43.23 95.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.861 0.362 . . . . 0.0 110.527 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -68.31 -36.0 78.67 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.728 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 92.9 t80 -72.09 -44.17 63.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.841 0.353 . . . . 0.0 110.634 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.673 ' HB2' HG11 ' A' ' 70' ' ' VAL . 86.3 mt -62.74 -31.16 72.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.491 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 37' ' ' LEU . 14.0 mt -85.95 3.16 43.3 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -176.336 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.608 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 13.5 t70 -78.99 138.17 37.93 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.061 178.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.7 m -57.21 -38.07 73.17 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -176.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.5 ptp180 -68.6 -32.81 72.96 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.544 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 66.6 t -79.43 -31.16 14.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.261 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.608 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 86.9 mtt180 -61.82 -26.72 68.29 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.224 0.535 . . . . 0.0 109.646 173.048 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.445 ' HA ' ' NE ' ' A' ' 43' ' ' ARG . 6.8 tpm_? -85.71 -19.21 31.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.515 -178.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.1 p -82.6 155.18 68.67 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 122.057 -0.402 . . . . 0.0 110.688 178.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.421 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 35.3 Cg_endo -66.63 157.13 62.4 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.444 2.096 . . . . 0.0 111.777 175.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.413 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -59.65 -34.98 73.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.88 -178.076 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.7 p -58.58 -43.5 89.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.229 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 71.1 m -65.24 -44.37 88.42 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.846 179.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.554 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 81.3 mttt -57.35 -49.64 75.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.123 -179.239 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 46' ' ' THR . 64.7 t -66.22 -42.52 91.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.005 -176.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 24.9 m170 -64.73 -42.63 95.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.159 -178.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -66.12 -41.74 90.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.412 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 81.2 mt -63.05 -40.68 98.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.869 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.402 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 49.5 tptt -60.92 -40.84 94.73 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.103 0.478 . . . . 0.0 110.015 175.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.0 t -67.46 -20.08 65.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.907 178.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -81.11 5.76 15.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.232 178.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.04 12.62 58.72 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.58 177.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.579 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.5 mp -83.34 170.11 14.92 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.523 0.678 . . . . 0.0 111.804 179.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.442 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 16.8 m -117.71 164.28 15.22 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.78 -1.1 . . . . 0.0 108.562 173.036 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.08 -35.93 72.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.732 0.301 . . . . 0.0 111.685 -175.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.1 mp0 -69.07 -37.27 78.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.054 0.454 . . . . 0.0 110.703 -177.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.442 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 1.5 mm-40 -68.44 -44.34 75.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.505 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 75.9 mt -62.5 -41.58 92.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.438 179.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 49.7 t -56.71 -42.99 80.14 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.99 178.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.691 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 26.9 tt0 -68.27 -48.4 65.13 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.52 179.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.467 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.0 -44.69 78.88 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.277 -177.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.526 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.2 m-85 -57.73 -42.81 84.63 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.902 0.382 . . . . 0.0 111.123 177.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.1 m -66.69 -33.12 74.93 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.331 0.586 . . . . 0.0 110.588 -178.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.691 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 25.2 mtpp -71.87 -31.95 66.96 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.471 -178.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.673 HG11 ' HB2' ' A' ' 36' ' ' LEU . 11.7 m -82.7 -3.91 7.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.813 0.339 . . . . 0.0 111.08 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 101.73 16.46 24.04 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.8 177.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -123.92 91.39 49.69 Favored Pre-proline 0 C--N 1.322 -0.622 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -71.43 101.61 1.16 Allowed 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 122.033 1.822 . . . . 0.0 112.115 -176.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -108.37 147.93 30.84 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.489 177.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 43.1 p -85.47 162.43 18.96 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.001 175.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.4 tp -63.64 -33.17 75.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.265 0.555 . . . . 0.0 109.714 177.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -61.83 -42.36 98.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.55 178.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.418 ' O ' HG13 ' A' ' 82' ' ' ILE . 24.5 mm-40 -56.03 -49.6 73.24 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.593 177.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.7 mm -62.72 -49.69 82.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.965 -174.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -64.14 -39.29 93.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.892 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 18.3 tpp180 -64.28 -45.14 89.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.94 178.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 78' ' ' GLU . 96.8 mt -63.15 -34.11 64.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.847 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.7 mt -77.0 -20.8 55.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.255 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 47.3 m . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.885 -0.578 . . . . 0.0 110.481 -179.033 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm . . . . . 0 N--CA 1.48 1.034 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -80.89 165.33 19.81 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.424 2.083 . . . . 0.0 112.592 -178.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -92.26 16.15 12.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.537 0.684 . . . . 0.0 109.932 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 10.0 t -99.02 -6.84 9.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.336 -176.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -57.19 125.53 23.14 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 28.1 m80 65.93 99.4 0.04 OUTLIER 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 -170.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.3 p -59.89 172.23 0.79 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.841 -174.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -57.16 -44.45 83.48 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.051 -175.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.9 m -68.79 -32.8 72.79 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 121.242 -0.183 . . . . 0.0 111.22 -178.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.51 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 48.4 mt-10 -71.61 -47.92 51.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.942 0.401 . . . . 0.0 110.588 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.413 ' O ' HG23 ' A' ' 29' ' ' VAL . 18.7 ptp180 -68.87 -40.41 79.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.235 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -62.22 -43.02 99.77 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.242 -179.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -69.99 -34.3 73.16 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.925 -177.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.533 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 63.2 mtm180 -64.72 -48.37 74.87 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 120.922 0.392 . . . . 0.0 109.956 177.174 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.564 ' O ' HG23 ' A' ' 33' ' ' VAL . 86.0 t -60.7 -42.55 92.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.185 176.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.5 t -58.93 -45.9 89.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.028 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -61.26 -36.19 79.34 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.006 0.432 . . . . 0.0 110.668 178.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.32 -44.58 62.48 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.048 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 29' ' ' VAL . 92.7 t -60.96 -43.51 96.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.799 0.333 . . . . 0.0 110.536 -179.29 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -68.76 -34.5 75.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.982 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -72.94 -43.37 62.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.061 0.457 . . . . 0.0 110.711 178.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.691 ' HB2' HG11 ' A' ' 70' ' ' VAL . 84.2 mt -65.66 -29.44 70.0 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.602 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.5 mt -84.18 6.36 22.84 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.585 -177.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.492 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 22.9 t70 -83.57 136.76 34.13 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.874 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.1 t -53.8 -43.68 69.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.038 -177.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -68.55 -42.67 78.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.157 0.503 . . . . 0.0 110.396 -177.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.502 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 86.9 t -66.94 -34.54 70.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.034 -179.171 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.492 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 83.9 mtp180 -67.19 -22.94 65.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.247 177.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 57.8 ttp180 -84.3 -18.12 37.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.751 0.31 . . . . 0.0 110.936 -178.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -85.73 158.68 56.35 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.66 -0.246 . . . . 0.0 110.709 175.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.45 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 31.7 Cg_endo -65.43 157.04 60.21 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 122.671 2.247 . . . . 0.0 112.574 -179.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.476 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.5 OUTLIER -60.37 -40.26 90.19 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.055 -177.411 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 11.0 m -58.12 -42.43 85.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.913 -177.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.43 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 56.4 m -62.75 -45.47 92.57 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.885 178.102 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.509 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 81.3 mttt -57.07 -49.37 76.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.996 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 46' ' ' THR . 99.6 t -64.77 -43.19 96.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.064 -176.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 29.0 m170 -64.45 -37.97 89.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.962 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.453 ' CE1' ' HE2' ' A' ' 56' ' ' LYS . 43.8 t80 -70.17 -42.77 72.02 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.514 -178.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 89.9 mt -64.0 -34.76 78.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.952 0.406 . . . . 0.0 110.801 178.558 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.447 ' HE3' ' HB3' ' A' ' 54' ' ' LYS . 0.5 OUTLIER -60.73 -43.5 97.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.336 175.199 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 45.8 m -69.79 -13.76 62.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.086 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 65.6 mttm -78.85 -8.18 58.58 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.315 174.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.4 20.72 28.99 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.047 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.533 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.7 mp -86.55 154.8 20.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.07 0.462 . . . . 0.0 111.254 178.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.512 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 13.1 m -93.84 161.87 14.15 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.19 174.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.24 -35.23 71.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.22 0.533 . . . . 0.0 110.875 -179.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -67.9 -38.89 83.54 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.527 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.512 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 4.2 mm-40 -65.89 -44.88 84.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.978 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 75.1 mt -62.04 -43.81 98.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.368 178.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 39.7 t -57.45 -44.17 84.54 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.753 176.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 70.1 tt0 -67.21 -47.28 71.33 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.838 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.514 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -57.45 -47.84 80.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.259 -179.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.596 ' O ' HG22 ' A' ' 70' ' ' VAL . 6.2 m-85 -57.05 -44.54 83.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.988 0.423 . . . . 0.0 111.087 178.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.1 m -65.09 -32.77 74.64 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.996 0.427 . . . . 0.0 110.626 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.471 ' HE3' HG21 ' A' ' 33' ' ' VAL . 19.1 mtmt -71.27 -31.7 67.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.75 179.069 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.691 HG11 ' HB2' ' A' ' 36' ' ' LEU . 11.0 m -82.29 -3.55 7.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-O 120.859 0.362 . . . . 0.0 111.439 -177.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 100.12 17.19 25.68 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.261 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.405 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 5.5 tp-100 -126.68 91.15 48.0 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -72.73 99.24 1.04 Allowed 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 121.706 1.604 . . . . 0.0 112.239 -176.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.476 ' HE3' HG21 ' A' ' 46' ' ' THR . 73.3 mmtt -107.59 137.37 45.74 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.193 175.447 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.452 ' OG1' ' HG2' ' A' ' 78' ' ' GLU . 76.7 p -80.69 159.41 25.29 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.398 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.418 ' HG ' ' HE2' ' A' ' 80' ' ' LYS . 52.6 tp -61.42 -33.22 73.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.813 178.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -61.16 -43.58 98.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.917 178.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.452 ' HG2' ' OG1' ' A' ' 75' ' ' THR . 21.6 mm-40 -59.13 -49.71 76.84 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.608 178.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 45.1 mm -62.66 -44.14 99.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.189 -174.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.418 ' HE2' ' HG ' ' A' ' 76' ' ' LEU . 61.6 mttm -63.89 -38.62 91.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.807 0.337 . . . . 0.0 110.927 -179.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 18.3 tpt180 -67.73 -44.48 77.51 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.775 177.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 78' ' ' GLU . 90.7 mt -62.16 -37.82 79.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.874 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.432 HD21 HG12 ' A' ' 50' ' ' VAL . 81.4 mt -78.21 -25.85 47.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.551 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 C--O 1.252 1.191 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.691 -178.556 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm . . . . . 0 N--CA 1.478 0.953 0 CA-C-O 121.127 0.489 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -82.66 165.12 15.99 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 123.234 2.622 . . . . 0.0 112.819 -173.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -90.33 13.57 15.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.204 0.526 . . . . 0.0 111.129 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 23.3 t -77.26 -24.34 14.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.516 0.674 . . . . 0.0 109.54 177.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -69.71 150.38 47.02 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.77 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 39.8 m80 -92.03 83.67 5.19 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.023 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 20.5 p -81.96 -77.42 0.22 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.083 0.468 . . . . 0.0 110.727 -178.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 38.6 p-80 -73.57 -22.46 60.06 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.376 -179.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.5 t -61.64 -35.04 76.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.555 -179.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.448 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 12.8 mt-10 -68.75 -47.74 65.52 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.941 -0.303 . . . . 0.0 111.043 178.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.52 ' HB2' ' OE2' ' A' ' 62' ' ' GLU . 0.1 OUTLIER -69.67 -37.38 76.67 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.35 -179.546 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -60.81 -44.04 97.41 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.213 -179.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 21.5 pttp -67.76 -34.24 76.42 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.436 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.476 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 39.8 mtm180 -66.05 -47.03 75.7 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.762 0.315 . . . . 0.0 110.523 179.233 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.498 ' O ' HG23 ' A' ' 33' ' ' VAL . 82.3 t -61.26 -42.68 94.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.215 177.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 35.8 m -58.69 -46.44 87.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.801 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -61.67 -36.0 79.58 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.083 0.468 . . . . 0.0 111.069 179.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.62 -44.41 62.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.006 179.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.517 HG13 HG12 ' A' ' 70' ' ' VAL . 75.6 t -60.82 -43.24 95.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.845 0.355 . . . . 0.0 110.575 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -69.22 -34.04 74.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.019 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -72.43 -43.52 63.71 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.885 0.374 . . . . 0.0 110.775 178.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.663 ' HB2' HG11 ' A' ' 70' ' ' VAL . 88.9 mt -66.51 -31.45 72.19 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.702 -177.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.6 mt -85.98 6.83 26.88 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.83 0.347 . . . . 0.0 111.918 -177.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.481 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 14.3 t70 -77.58 135.88 38.21 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 176.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.7 m -57.8 -36.17 71.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.74 0.305 . . . . 0.0 111.698 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -69.21 -41.56 76.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.196 0.522 . . . . 0.0 110.612 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.491 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 88.8 t -72.37 -32.93 44.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.876 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.481 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 24.6 mtp180 -66.08 -21.62 66.38 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.577 175.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -80.99 -17.88 48.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.132 -177.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -92.02 158.72 39.13 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.132 178.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.415 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 32.8 Cg_endo -64.82 156.9 59.27 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.885 2.39 . . . . 0.0 112.347 178.318 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.489 HG21 ' HE3' ' A' ' 74' ' ' LYS . 1.1 m -65.7 -38.08 88.23 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.599 -174.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.3 m -58.69 -38.43 78.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.951 0.405 . . . . 0.0 110.731 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 75.5 m -65.88 -44.25 85.92 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.827 176.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.491 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 86.8 mttt -57.27 -47.74 80.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.546 178.322 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 46' ' ' THR . 82.3 t -63.87 -46.1 95.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.167 -177.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -64.16 -37.21 86.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.983 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -64.08 -47.23 80.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.463 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 96.2 mt -64.04 -37.07 86.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.942 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -59.29 -43.26 92.57 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.13 0.49 . . . . 0.0 110.436 176.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.4 m -70.52 -16.6 62.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.505 -179.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.4 mmtp -85.41 -4.32 59.12 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 120.781 0.324 . . . . 0.0 111.199 177.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.81 13.71 31.27 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.73 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.476 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.0 mp -87.31 149.88 24.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.189 0.518 . . . . 0.0 111.709 178.059 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.44 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 16.8 m -94.04 167.63 11.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.519 175.44 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.73 -38.16 80.92 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -177.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -65.89 -37.51 86.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.112 0.482 . . . . 0.0 110.406 -179.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.52 ' OE2' ' HB2' ' A' ' 25' ' ' ARG . 3.1 mm-40 -64.46 -47.45 78.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.682 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.76 -45.47 98.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.627 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 53.7 t -58.13 -44.71 87.95 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.168 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.636 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 29.9 tt0 -67.48 -48.32 67.48 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.663 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.498 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.65 -44.02 80.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.458 -178.149 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.549 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.4 m-85 -58.53 -41.85 86.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.974 0.416 . . . . 0.0 111.207 179.057 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.8 m -65.77 -34.22 77.67 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.233 0.539 . . . . 0.0 110.422 -177.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.636 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 4.4 mtpm? -71.46 -31.2 66.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.957 179.249 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.663 HG11 ' HB2' ' A' ' 36' ' ' LEU . 11.0 m -83.48 4.13 2.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.811 0.338 . . . . 0.0 111.23 -178.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 94.02 17.45 40.6 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.606 176.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -127.1 91.55 46.42 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -70.28 98.26 0.73 Allowed 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 121.748 1.632 . . . . 0.0 112.328 -177.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.489 ' HE3' HG21 ' A' ' 46' ' ' THR . 71.6 mmtt -106.61 140.19 39.87 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.799 177.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 30.6 p -86.06 156.57 20.35 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.26 178.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 37.5 tp -62.42 -32.3 73.12 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -56.81 -45.48 82.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.501 176.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.419 ' O ' HG13 ' A' ' 82' ' ' ILE . 33.0 mt-10 -61.79 -48.76 79.18 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.71 177.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 46.4 mm -60.29 -46.27 95.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.839 -176.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -63.02 -38.06 89.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.948 178.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.1 tpp180 -67.9 -44.15 77.64 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.697 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 78' ' ' GLU . 93.6 mt -64.67 -36.49 77.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.845 -179.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.7 mt -78.98 -25.27 43.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.328 178.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 C--O 1.252 1.203 0 CA-C-O 119.053 -0.499 . . . . 0.0 110.578 -176.903 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 110.143 -0.318 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -65.09 115.37 3.26 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.204 1.936 . . . . 0.0 111.122 173.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -95.43 26.89 3.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.233 0.54 . . . . 0.0 111.215 -177.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.5 p -78.87 -10.73 12.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.95 0.881 . . . . 0.0 109.298 170.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -84.85 152.18 23.77 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.048 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 39.2 m80 70.95 153.59 0.12 Allowed 'General case' 0 N--CA 1.466 0.337 0 O-C-N 123.814 0.696 . . . . 0.0 111.144 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.6 p -80.83 83.6 6.54 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.372 0.606 . . . . 0.0 110.8 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.417 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . 22.6 p80 -71.15 -21.83 62.13 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.652 -178.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.9 p -63.86 -43.91 94.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.011 0.434 . . . . 0.0 110.393 175.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.483 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 64.2 mt-10 -68.17 -40.86 82.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.774 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.611 ' HB2' ' OE2' ' A' ' 62' ' ' GLU . 7.8 ptm180 -69.18 -38.95 78.95 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.211 178.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -63.52 -44.06 95.35 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.012 -178.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 14.2 ptmm? -63.78 -32.1 73.49 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.6 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.503 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 35.2 mtm180 -67.21 -44.5 79.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.402 177.444 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.628 ' O ' HG23 ' A' ' 33' ' ' VAL . 87.5 t -61.1 -46.84 95.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.156 177.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.1 m -62.4 -43.77 98.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.343 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -61.78 -36.04 79.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.124 0.488 . . . . 0.0 110.537 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.468 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -69.94 -43.89 70.69 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.584 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.628 HG23 ' O ' ' A' ' 29' ' ' VAL . 90.3 t -60.32 -46.23 95.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.011 0.434 . . . . 0.0 110.393 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.89 -33.7 74.2 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.26 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -72.1 -43.7 64.37 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.787 0.327 . . . . 0.0 110.789 177.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.711 ' HB2' HG11 ' A' ' 70' ' ' VAL . 95.1 mt -65.02 -31.3 72.46 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.213 -179.058 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 37' ' ' LEU . 16.5 mt -85.84 5.84 30.9 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.991 -177.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.61 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 10.6 t70 -74.28 134.0 42.62 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 177.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 m -52.15 -36.7 52.24 Favored 'General case' 0 C--N 1.328 -0.365 0 O-C-N 123.386 0.428 . . . . 0.0 111.652 -176.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 84.5 mtm180 -68.86 -44.42 73.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.181 0.515 . . . . 0.0 110.978 178.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.529 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.3 t -70.96 -26.69 28.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.681 -176.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.61 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 52.1 mtt180 -62.39 -22.49 66.19 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.421 174.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -90.27 -18.4 25.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.73 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.1 p -81.57 152.71 70.21 Favored Pre-proline 0 C--N 1.326 -0.433 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.63 177.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.416 ' HG2' ' OG ' ' A' ' 48' ' ' SER . 26.4 Cg_endo -63.8 154.53 69.06 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.309 2.006 . . . . 0.0 111.912 177.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.417 ' O ' HG23 ' A' ' 50' ' ' VAL . 1.5 m -59.5 -39.54 84.16 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.249 -177.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.418 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 13.8 m -58.26 -42.26 86.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.843 -179.038 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.416 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 74.4 m -62.47 -44.27 96.81 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.152 178.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.529 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 84.7 mttt -57.65 -49.97 74.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.26 179.345 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.584 HG12 HD21 ' A' ' 83' ' ' LEU . 61.6 t -64.69 -40.96 90.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.113 -176.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 36.7 m170 -64.92 -38.37 90.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.903 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -64.68 -47.0 80.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.885 0.374 . . . . 0.0 110.359 179.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.477 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 90.1 mt -62.59 -37.68 87.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.134 -179.076 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.607 ' HD3' HD22 ' A' ' 83' ' ' LEU . 38.3 ttpt -60.74 -42.19 96.85 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.313 0.578 . . . . 0.0 110.029 175.048 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.6 t -63.19 -24.77 68.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.811 178.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -85.1 7.21 22.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.391 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.8 7.94 70.43 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.623 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.503 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.4 mp -75.85 147.74 38.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.349 0.595 . . . . 0.0 111.125 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.504 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 14.9 m -91.2 162.9 14.45 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.786 174.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.01 -35.93 71.95 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.99 0.424 . . . . 0.0 111.14 -177.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -63.91 -41.61 97.62 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.247 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.611 ' OE2' ' HB2' ' A' ' 25' ' ' ARG . 3.1 mm-40 -63.63 -45.63 89.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.422 0.63 . . . . 0.0 109.543 -178.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.436 HG23 HD12 ' A' ' 53' ' ' LEU . 63.2 mt -62.99 -43.65 99.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.709 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 40.3 t -56.59 -46.18 80.96 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.139 178.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -68.01 -47.68 67.79 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.698 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.561 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.92 -46.31 82.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.902 -179.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.576 ' O ' HG22 ' A' ' 70' ' ' VAL . 2.6 m-85 -57.21 -45.72 83.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.247 179.316 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.9 m -65.25 -33.46 76.04 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.436 -177.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.496 ' HE3' HG21 ' A' ' 33' ' ' VAL . 25.9 mtmt -72.63 -27.04 61.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.996 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.711 HG11 ' HB2' ' A' ' 36' ' ' LEU . 8.6 m -87.05 3.45 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-O 120.841 0.353 . . . . 0.0 111.217 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 94.56 15.77 45.4 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.571 -0.824 . . . . 0.0 112.623 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -124.17 91.58 49.39 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -71.71 99.79 0.99 Allowed 'Trans proline' 0 N--CA 1.455 -0.758 0 C-N-CA 121.997 1.798 . . . . 0.0 112.332 -176.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -113.12 140.94 47.47 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.922 176.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 33.2 p -82.93 167.91 17.54 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.596 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 60.5 tp -63.0 -33.86 76.32 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 174.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -62.23 -43.63 98.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.458 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -57.06 -48.58 78.22 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.818 178.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.9 mm -61.33 -48.88 86.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.825 -176.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -64.64 -35.38 80.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.846 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.8 tpt180 -61.98 -45.77 92.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.247 0.546 . . . . 0.0 110.348 175.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.418 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 78.4 mt -68.1 -33.96 63.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.172 -178.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.607 HD22 ' HD3' ' A' ' 54' ' ' LYS . 87.5 mt -81.79 -20.68 38.66 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.906 178.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 71.5 m . . . . . 0 C--O 1.252 1.223 0 CA-C-O 117.963 -1.018 . . . . 0.0 111.684 179.236 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -74.91 115.19 4.21 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.371 2.047 . . . . 0.0 111.793 176.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -139.19 80.99 1.81 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.259 0.552 . . . . 0.0 110.394 -179.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 25.0 t -101.61 -31.63 3.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.244 176.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -70.09 153.47 43.13 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.805 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 10.9 p-80 -105.83 66.78 0.73 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.406 0.622 . . . . 0.0 110.167 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.2 m -66.35 -29.98 70.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.474 -175.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -67.53 -43.72 80.11 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 177.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.6 m -64.19 -34.33 77.84 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.37 177.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 66.7 mm-40 -64.8 -47.28 78.64 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.527 178.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.0 ptm180 -69.79 -37.09 76.19 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.387 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -64.67 -42.99 94.98 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.477 -179.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -67.16 -32.31 73.33 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 121.036 -0.265 . . . . 0.0 110.546 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 37.5 mtm-85 -68.45 -41.24 80.55 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 177.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.571 ' O ' HG23 ' A' ' 33' ' ' VAL . 69.2 t -60.91 -44.87 98.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.303 -0.408 . . . . 0.0 109.994 174.308 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.1 m -58.77 -42.2 88.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.021 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.512 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 23.3 m-80 -66.48 -34.76 78.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.051 0.453 . . . . 0.0 110.994 177.153 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.59 -43.99 65.27 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.108 177.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 29' ' ' VAL . 94.4 t -61.25 -40.93 87.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.847 0.356 . . . . 0.0 110.752 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 12.3 pt-20 -68.94 -37.49 78.91 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.563 178.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -72.28 -43.53 64.12 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.161 -179.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.592 ' HB2' HG11 ' A' ' 70' ' ' VAL . 74.0 mt -65.1 -31.68 73.0 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.45 -179.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.3 mt -85.79 6.48 27.79 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -176.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -76.87 139.05 40.13 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 177.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.411 ' HA ' ' HG2' ' A' ' 42' ' ' ARG . 20.9 t -59.45 -31.78 69.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.85 0.357 . . . . 0.0 111.057 -178.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -68.53 -42.69 78.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.372 0.606 . . . . 0.0 110.549 178.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 93.6 t -79.52 -32.26 14.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.271 -171.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.411 ' HG2' ' HA ' ' A' ' 39' ' ' SER . 17.3 ptp180 -67.92 -22.2 65.08 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.118 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -83.98 -18.09 38.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.72 0.295 . . . . 0.0 111.496 -178.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.09 162.93 50.35 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 116.638 -0.256 . . . . 0.0 110.756 177.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -63.97 157.9 50.33 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.626 2.217 . . . . 0.0 112.376 179.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.419 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -62.69 -35.18 78.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.075 -178.388 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.556 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 14.6 p -58.73 -43.66 90.26 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.402 -178.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.3 m -61.12 -45.93 92.68 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.965 178.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.465 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 82.0 mttt -57.34 -50.3 73.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.564 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 92.1 t -65.57 -44.91 93.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.201 -174.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 27.3 m170 -64.48 -35.99 82.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.005 -177.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -70.19 -38.53 75.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.277 -178.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 82.5 mt -69.83 -37.62 76.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.699 178.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -62.56 -38.26 89.34 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.162 0.506 . . . . 0.0 109.851 174.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.5 t -67.1 -19.96 65.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.441 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 69.0 mmtt -80.81 -8.37 59.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.768 177.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.07 15.67 38.08 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.601 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.9 mp -80.94 145.56 31.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.104 0.478 . . . . 0.0 111.402 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.2 m -82.28 163.46 21.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.539 173.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.73 -41.1 85.63 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.843 0.354 . . . . 0.0 111.246 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -70.55 -30.37 67.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.393 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -66.97 -45.73 76.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.225 0.535 . . . . 0.0 109.941 175.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 64.7 mt -62.67 -43.09 98.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.232 177.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 43.9 t -56.76 -43.62 80.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.836 176.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.98 -48.56 65.46 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.824 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.1 -42.62 81.09 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.281 -179.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.464 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.3 m-85 -60.8 -47.57 85.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.917 177.601 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 21.8 m -64.07 -34.96 79.21 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.04 0.448 . . . . 0.0 110.255 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mmmt -62.79 -35.39 79.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.602 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.592 HG11 ' HB2' ' A' ' 36' ' ' LEU . 22.4 m -87.42 7.23 2.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -176.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.6 18.39 48.64 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.657 177.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -123.75 90.97 50.18 Favored Pre-proline 0 C--N 1.322 -0.613 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 177.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -71.92 97.71 0.84 Allowed 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 121.903 1.736 . . . . 0.0 112.437 -176.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.419 ' HE3' HG21 ' A' ' 46' ' ' THR . 69.3 mmtt -106.97 137.96 44.06 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.848 176.119 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.7 p -80.64 162.05 24.4 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.409 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 64.7 tp -61.42 -33.61 74.0 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 175.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -60.18 -44.32 95.14 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.365 176.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.441 ' O ' HG13 ' A' ' 82' ' ' ILE . 8.7 mm-40 -61.21 -47.3 86.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.125 177.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.8 mm -60.13 -47.44 91.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.888 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -62.42 -40.85 97.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.13 0.491 . . . . 0.0 110.548 177.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -59.89 -47.02 87.45 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.747 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.556 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 88.8 mt -66.72 -31.64 54.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.09 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.1 mt -77.73 -12.57 59.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.204 178.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 25.9 p . . . . . 0 C--O 1.252 1.187 0 CA-C-O 119.036 -0.507 . . . . 0.0 110.577 177.305 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.9 pttp . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -74.97 140.18 25.24 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.016 1.81 . . . . 0.0 111.399 175.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -85.73 81.05 8.76 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.516 0.674 . . . . 0.0 109.762 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 40.8 t -81.99 -32.28 11.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.221 -178.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -98.97 154.74 17.84 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.287 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 42.7 p-80 -122.51 40.01 3.78 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 178.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.7 m -54.47 -31.97 56.83 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.307 -0.861 . . . . 0.0 112.314 -175.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.9 m170 -67.2 -40.6 86.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.216 0.531 . . . . 0.0 109.682 177.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 m -70.67 -29.88 66.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.024 177.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.604 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 61.9 mm-40 -65.63 -46.77 78.0 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.691 175.316 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.6 ' HB2' ' OE2' ' A' ' 62' ' ' GLU . 0.2 OUTLIER -67.99 -37.62 81.71 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.858 178.591 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.537 ' N ' ' HG3' ' A' ' 25' ' ' ARG . 35.2 tt0 -60.75 -44.05 97.18 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.551 -178.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 22.0 ptmt -68.28 -33.51 74.48 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.358 -179.457 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.604 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 34.8 mtm180 -63.19 -46.31 87.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 0.0 110.506 178.149 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.575 ' O ' HG23 ' A' ' 33' ' ' VAL . 97.9 t -61.74 -46.76 95.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.589 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.1 p -62.0 -38.51 88.88 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.247 -0.181 . . . . 0.0 111.428 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -61.15 -41.14 96.21 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.23 0.538 . . . . 0.0 110.37 176.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.69 -44.84 63.52 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.117 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.575 HG23 ' O ' ' A' ' 29' ' ' VAL . 87.0 t -61.49 -42.14 92.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.745 -179.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -69.23 -36.13 76.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.644 0.259 . . . . 0.0 110.829 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -71.97 -43.8 64.58 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.875 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.699 ' HB2' HG11 ' A' ' 70' ' ' VAL . 86.9 mt -65.74 -29.98 70.57 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.538 -178.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.509 ' HG ' HG12 ' A' ' 70' ' ' VAL . 12.2 mt -85.13 6.32 26.11 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -176.204 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.491 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 25.6 t70 -79.51 138.71 37.62 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.348 177.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.441 ' O ' ' HG2' ' A' ' 43' ' ' ARG . 23.1 m -57.04 -41.57 78.87 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -176.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.9 mmp_? -68.71 -38.55 80.34 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.087 0.47 . . . . 0.0 110.206 179.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.4 ' O ' ' NZ ' ' A' ' 49' ' ' LYS . 61.9 t -71.64 -25.15 24.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.387 179.109 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.491 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 71.0 mtp180 -72.75 -20.53 61.17 Favored 'General case' 0 C--N 1.319 -0.738 0 O-C-N 122.051 -0.406 . . . . 0.0 110.895 172.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.441 ' HG2' ' O ' ' A' ' 39' ' ' SER . 32.4 mmm180 -96.18 10.73 36.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.738 -177.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.502 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -110.12 168.08 8.15 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.677 178.249 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.502 ' HD2' HG22 ' A' ' 44' ' ' THR . 57.9 Cg_endo -70.73 156.26 61.14 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.425 2.083 . . . . 0.0 111.71 175.332 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.45 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -67.21 -34.01 76.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.898 0.38 . . . . 0.0 111.067 -177.138 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.489 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 11.5 p -58.39 -42.16 86.49 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.513 -176.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.9 m -61.6 -42.33 98.71 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.877 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.496 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 21.1 mttm -63.97 -47.41 80.5 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.654 -178.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.482 HG12 HD21 ' A' ' 83' ' ' LEU . 68.5 t -63.82 -44.41 98.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.743 -175.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -65.11 -40.52 94.64 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.743 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -62.53 -47.36 84.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.586 178.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 89.9 mt -64.58 -36.47 84.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.982 -178.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.481 ' HD2' HD22 ' A' ' 83' ' ' LEU . 78.9 tttt -64.3 -38.12 89.91 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 120.929 0.395 . . . . 0.0 110.241 176.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.2 t -66.68 -25.19 66.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.058 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.7 mmtt -78.12 -4.29 46.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.078 178.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.8 8.46 54.26 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.457 178.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.483 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.8 mp -80.43 146.62 31.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.454 0.645 . . . . 0.0 111.333 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.3 m -89.41 165.74 14.16 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.328 175.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.0 -37.27 76.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.962 0.41 . . . . 0.0 110.958 -178.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -64.13 -42.5 96.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.708 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.6 ' OE2' ' HB2' ' A' ' 25' ' ' ARG . 4.8 mm-40 -64.11 -44.81 91.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.38 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.45 HG23 HD12 ' A' ' 53' ' ' LEU . 77.2 mt -61.51 -42.89 95.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.299 178.065 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 43.5 t -57.88 -46.0 85.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.967 177.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -68.11 -45.11 74.6 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.247 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.44 -41.74 81.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.61 0.243 . . . . 0.0 111.207 -178.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.482 ' O ' HG22 ' A' ' 70' ' ' VAL . 8.9 m-85 -61.48 -46.33 90.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.052 0.453 . . . . 0.0 110.595 176.247 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 20.2 m -63.25 -32.84 74.35 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.089 0.471 . . . . 0.0 110.402 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 12.7 mmmt -66.74 -33.37 75.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.882 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.699 HG11 ' HB2' ' A' ' 36' ' ' LEU . 22.0 m -87.22 -0.17 7.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.729 0.299 . . . . 0.0 111.632 -177.428 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 99.27 16.29 30.29 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.579 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -122.86 91.43 49.73 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 178.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -70.84 100.57 0.96 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 121.786 1.657 . . . . 0.0 112.125 -177.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.45 ' HE3' HG21 ' A' ' 46' ' ' THR . 67.5 mmtt -105.22 142.6 34.71 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.679 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 41.6 p -83.12 156.01 23.51 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.289 178.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.87 -32.56 73.83 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 177.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.5 t30 -58.28 -45.78 87.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.748 177.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -59.3 -46.68 87.91 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.189 179.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 41.6 mm -60.3 -45.47 96.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.524 -177.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -64.29 -39.85 94.77 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.015 0.436 . . . . 0.0 110.858 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 64.5 ttt180 -60.11 -46.56 89.21 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.548 177.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.489 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 89.8 mt -67.35 -31.94 55.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.305 -0.862 . . . . 0.0 111.298 -179.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.482 HD21 HG12 ' A' ' 50' ' ' VAL . 90.4 mt -83.14 -14.25 53.95 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.332 179.001 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 21.8 p . . . . . 0 C--O 1.25 1.103 0 C-N-CA 123.653 0.781 . . . . 0.0 111.76 -179.242 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt . . . . . 0 N--CA 1.478 0.942 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -70.63 155.7 62.56 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.458 2.105 . . . . 0.0 111.494 175.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -147.39 100.7 3.29 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 7.8 p -129.81 -16.01 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.168 -176.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.46 119.67 10.19 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 120.795 0.331 . . . . 0.0 110.347 -179.369 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 12.2 t60 -88.9 -72.93 0.52 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.185 -0.462 . . . . 0.0 109.912 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.2 m -148.01 17.01 1.09 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.189 0.518 . . . . 0.0 110.691 178.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 49.9 m-70 -69.95 -44.09 70.23 Favored 'General case' 0 CA--C 1.519 -0.237 0 O-C-N 122.118 -0.363 . . . . 0.0 110.738 -176.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -70.17 -33.07 71.31 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -176.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.422 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 9.2 tp10 -64.45 -48.29 75.82 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.043 177.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -67.06 -47.41 71.4 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.395 178.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -58.02 -43.86 86.99 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.498 -176.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.9 pttm -71.78 -33.82 68.91 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.953 -177.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.449 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 25.0 mtm180 -67.64 -48.1 67.69 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.772 0.32 . . . . 0.0 110.398 178.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.593 ' O ' HG23 ' A' ' 33' ' ' VAL . 98.3 t -60.94 -39.95 83.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.821 176.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.8 t -58.37 -45.45 88.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.502 178.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.441 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 93.3 m-20 -62.59 -37.74 87.43 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.733 178.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.66 -45.04 63.17 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.414 -179.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.593 HG23 ' O ' ' A' ' 29' ' ' VAL . 93.1 t -61.16 -41.91 91.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.87 0.367 . . . . 0.0 110.654 -178.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 10.4 pt-20 -68.93 -37.5 78.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.713 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -71.6 -43.01 67.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.936 0.398 . . . . 0.0 110.841 -179.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.672 ' HB2' HG11 ' A' ' 70' ' ' VAL . 84.0 mt -65.01 -30.39 71.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.577 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.3 mt -85.18 7.03 23.32 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -176.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.496 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 11.3 t70 -80.12 135.95 36.42 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 176.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.457 ' O ' ' HG3' ' A' ' 43' ' ' ARG . 15.4 p -57.12 -36.95 71.27 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.871 0.367 . . . . 0.0 111.48 -176.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 80.7 mtm180 -68.58 -38.96 81.11 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.273 0.559 . . . . 0.0 110.262 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 57.9 t -78.5 -25.03 13.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.228 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 79.7 mtp180 -72.69 -33.12 66.27 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.72 -0.392 . . . . 0.0 112.043 178.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 39' ' ' SER . 77.1 mtp180 -81.32 -10.25 59.6 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -173.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.522 HG22 ' HD2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -79.41 173.54 7.56 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.76 -0.2 . . . . 0.0 110.632 177.087 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.522 ' HD2' HG22 ' A' ' 44' ' ' THR . 46.4 Cg_endo -68.62 155.65 68.19 Favored 'Trans proline' 0 C--O 1.239 0.54 0 C-N-CA 121.941 1.761 . . . . 0.0 111.249 171.003 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.37 -33.69 74.72 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.812 0.339 . . . . 0.0 111.019 -177.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.457 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 15.4 p -57.78 -42.64 84.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.259 -176.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.1 m -62.1 -43.82 97.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.111 -179.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -62.05 -47.43 84.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.476 -177.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 76.6 t -64.53 -43.52 96.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.73 -177.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 37.8 m170 -64.87 -37.71 88.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.504 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -63.86 -51.24 65.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.436 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.412 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 91.6 mt -62.24 -36.28 81.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.063 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.19 -43.42 95.92 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.23 0.538 . . . . 0.0 110.309 176.566 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.2 t -70.68 -14.21 62.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.238 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -86.73 0.75 54.11 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.843 0.354 . . . . 0.0 110.925 177.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.65 10.32 50.49 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.475 177.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.449 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.8 mp -88.56 148.02 24.31 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.372 0.606 . . . . 0.0 111.119 178.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.401 ' O ' HG13 ' A' ' 63' ' ' ILE . 50.9 m -95.28 173.13 7.7 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.942 -1.027 . . . . 0.0 109.771 176.085 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.83 87.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.924 0.392 . . . . 0.0 111.313 -177.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -67.58 -35.51 79.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.261 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -64.17 -45.98 86.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.459 0.647 . . . . 0.0 109.51 178.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 59' ' ' SER . 64.4 mt -65.19 -43.65 95.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.816 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 53.2 t -57.36 -43.22 83.32 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.915 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.47 -48.62 66.65 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.762 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.495 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -57.2 -47.62 80.81 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.198 -178.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.552 ' O ' HG22 ' A' ' 70' ' ' VAL . 5.1 m-85 -56.93 -45.83 82.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.278 179.115 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.6 m -64.91 -33.14 75.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.965 0.412 . . . . 0.0 110.584 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.1 mtmt -70.56 -31.62 68.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.973 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.672 HG11 ' HB2' ' A' ' 36' ' ' LEU . 14.3 m -83.68 -3.78 7.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.836 0.35 . . . . 0.0 111.457 -176.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 101.14 18.49 19.48 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.339 178.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -126.87 91.39 47.21 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 177.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -72.87 101.72 1.35 Allowed 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 121.711 1.608 . . . . 0.0 112.281 -176.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -111.26 140.51 45.76 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.64 175.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 47.3 p -81.92 165.52 20.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.956 0.408 . . . . 0.0 110.474 177.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.4 -33.02 74.64 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.784 177.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -63.49 -42.15 98.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.076 178.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.503 ' O ' HG13 ' A' ' 82' ' ' ILE . 2.7 mm-40 -58.14 -48.19 81.01 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.829 177.002 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 42.3 mm -62.69 -42.11 94.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.468 -178.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -61.96 -43.69 98.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.974 0.416 . . . . 0.0 110.572 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 27.2 tpt180 -60.67 -45.89 92.43 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.353 -0.839 . . . . 0.0 111.078 178.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 78' ' ' GLU . 82.8 mt -67.91 -35.6 72.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.102 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 71.5 mt -77.8 -13.4 59.9 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 -179.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 20.8 p . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.474 -0.774 . . . . 0.0 109.975 175.675 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.4 tptm . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -76.68 91.82 1.13 Allowed 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.27 1.98 . . . . 0.0 111.738 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.419 ' CG ' ' HA ' ' A' ' 21' ' ' THR . 41.3 tt0 -97.72 93.71 6.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.138 0.494 . . . . 0.0 111.328 -176.761 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.5 t -111.29 -55.85 4.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 171.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.502 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -109.16 -19.55 13.3 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.718 -1.128 . . . . 0.0 110.221 179.045 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 60.4 m80 -85.3 28.17 0.75 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.598 -178.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.471 ' HB ' ' HG2' ' A' ' 24' ' ' GLU . 19.5 m -56.63 133.96 54.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.701 179.218 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -63.97 -35.06 79.44 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.888 0.375 . . . . 0.0 110.015 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.7 m -60.09 -34.04 72.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.35 175.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.563 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 35.6 mm-40 -65.35 -47.84 75.04 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.898 179.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.47 ' HG3' ' N ' ' A' ' 26' ' ' GLU . 8.2 ptm180 -66.54 -37.25 84.6 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.703 179.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.47 ' N ' ' HG3' ' A' ' 25' ' ' ARG . 40.9 tt0 -62.06 -45.09 95.07 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.764 -179.231 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 13.7 ptmm? -73.01 -34.96 66.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.861 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.563 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 28.2 mtm180 -66.51 -41.11 89.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.502 0.191 . . . . 0.0 110.772 178.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 25' ' ' ARG . 70.6 t -63.09 -41.96 94.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 175.491 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.4 m -58.6 -46.96 85.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.262 176.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -62.37 -38.41 89.46 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.142 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.441 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -70.43 -45.34 66.05 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.168 -177.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.581 HG13 HG12 ' A' ' 70' ' ' VAL . 71.3 t -61.5 -44.68 98.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.877 0.37 . . . . 0.0 110.454 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -69.43 -33.66 73.29 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.924 -179.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -71.4 -43.07 67.51 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.953 0.406 . . . . 0.0 110.388 179.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.682 ' HB2' HG11 ' A' ' 70' ' ' VAL . 90.4 mt -64.27 -29.22 70.32 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.27 178.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.4 mt -85.35 6.5 26.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.168 -0.469 . . . . 0.0 112.084 -178.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -82.13 139.0 34.62 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.214 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.503 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 25.1 t -58.21 -37.4 74.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.628 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -68.18 -37.03 80.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.16 0.505 . . . . 0.0 110.438 -179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.572 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 60.0 t -79.33 -34.21 16.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.34 -176.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.503 ' HG2' ' O ' ' A' ' 39' ' ' SER . 39.6 ptt180 -68.26 -22.21 64.77 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.79 0.329 . . . . 0.0 110.543 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.2 ttp180 -84.75 -19.22 33.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.867 -178.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.22 161.35 49.44 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.92 178.336 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.415 ' HG2' ' OG ' ' A' ' 48' ' ' SER . 32.6 Cg_endo -63.53 155.99 59.43 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.687 2.258 . . . . 0.0 112.264 177.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.425 HG21 ' HE3' ' A' ' 74' ' ' LYS . 0.8 OUTLIER -61.69 -38.28 87.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.291 -177.509 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.8 m -58.76 -41.13 85.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.01 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.415 ' OG ' ' HG2' ' A' ' 45' ' ' PRO . 62.2 m -61.77 -45.99 91.51 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.801 178.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.572 ' HE2' ' O ' ' A' ' 41' ' ' VAL . 80.1 mttt -56.91 -49.18 76.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.241 178.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.433 HG13 HG21 ' A' ' 63' ' ' ILE . 84.5 t -63.23 -45.28 98.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.143 -177.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 39.8 m170 -64.83 -37.24 86.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.964 -178.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -66.71 -45.99 76.98 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.691 0.281 . . . . 0.0 110.349 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 88.1 mt -62.23 -37.4 85.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.69 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.2 tppt? -59.79 -42.55 93.62 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.152 174.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.6 m -67.51 -15.32 63.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.973 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 27.6 mmtp -86.77 -4.6 59.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.901 177.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.15 7.68 55.93 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.858 -0.686 . . . . 0.0 112.753 178.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.453 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 5.1 mp -73.13 150.4 42.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.368 0.604 . . . . 0.0 111.602 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.6 m -90.88 161.28 15.29 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.362 -0.835 . . . . 0.0 108.78 173.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.27 -38.71 77.51 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.989 0.424 . . . . 0.0 110.498 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.474 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 1.8 mp0 -59.64 -43.16 93.95 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.716 177.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.11 -43.66 77.9 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.77 -178.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.433 HG21 HG13 ' A' ' 50' ' ' VAL . 74.7 mt -60.78 -44.34 97.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.079 176.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 52.9 t -59.37 -43.94 92.8 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.721 178.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.715 ' O ' ' HG3' ' A' ' 69' ' ' LYS . 30.3 tt0 -67.53 -48.99 65.43 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.879 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.477 ' O ' HG13 ' A' ' 70' ' ' VAL . . . -56.65 -45.24 81.74 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 120.54 0.21 . . . . 0.0 111.047 -178.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.569 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.7 m-85 -57.04 -44.95 83.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.927 0.394 . . . . 0.0 111.055 177.448 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 17.8 m -65.14 -33.14 75.32 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.251 0.548 . . . . 0.0 110.485 -177.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.715 ' HG3' ' O ' ' A' ' 65' ' ' GLU . 20.7 mtpp -71.65 -32.34 67.82 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.797 -179.21 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.682 HG11 ' HB2' ' A' ' 36' ' ' LEU . 15.2 m -81.9 -4.41 7.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 121.049 -0.261 . . . . 0.0 111.314 -177.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 102.04 16.66 22.84 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.407 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.421 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 5.6 tp-100 -126.79 90.93 48.43 Favored Pre-proline 0 C--N 1.323 -0.587 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -74.02 99.43 1.17 Allowed 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 121.974 1.783 . . . . 0.0 112.268 -176.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.425 ' HE3' HG21 ' A' ' 46' ' ' THR . 72.7 mmtt -106.46 138.08 43.29 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.557 175.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.425 ' O ' HG12 ' A' ' 79' ' ' ILE . 63.7 p -77.32 156.31 31.41 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 37.8 tp -62.94 -32.69 74.06 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -60.79 -46.08 91.88 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.626 175.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -60.44 -43.76 96.48 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.383 178.357 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 75' ' ' THR . 45.7 mm -60.35 -43.25 93.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.533 0.206 . . . . 0.0 110.684 -178.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -63.98 -41.35 97.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.295 0.569 . . . . 0.0 110.649 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -59.8 -42.45 93.44 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.825 177.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 79.8 mt -73.91 -32.69 34.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.288 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 64.3 mt -80.92 -1.97 45.7 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.248 1.011 0 CA-C-O 119.144 -0.455 . . . . 0.0 110.485 175.857 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.41 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 49.5 mttp . . . . . 0 N--CA 1.476 0.873 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.11 102.94 0.22 Allowed 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 121.988 1.792 . . . . 0.0 110.185 167.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 15' ' ' LYS . 78.7 mm-40 -89.56 8.41 31.37 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -167.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.6 t -104.38 -56.08 5.31 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-O 121.182 0.515 . . . . 0.0 110.589 -179.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -102.57 -27.5 12.72 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.985 -178.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 65.82 -79.81 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 O-C-N 123.85 0.719 . . . . 0.0 111.417 -179.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.5 m -91.43 94.05 9.29 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.208 0.528 . . . . 0.0 110.852 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.498 ' O ' ' HG2' ' A' ' 25' ' ' ARG . 37.7 m80 -66.19 -32.26 73.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.441 177.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -60.96 -33.78 73.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.935 0.398 . . . . 0.0 110.361 178.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.562 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 36.7 tt0 -68.88 -45.11 71.85 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.44 -179.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.498 ' HG2' ' O ' ' A' ' 22' ' ' HIS . 25.0 ptt180 -67.56 -37.31 82.47 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.664 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -60.5 -44.86 95.54 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.258 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -71.44 -32.95 68.93 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.201 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.562 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 31.9 mtm180 -65.9 -44.22 85.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.746 -0.206 . . . . 0.0 110.65 177.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.566 ' O ' HG23 ' A' ' 33' ' ' VAL . 94.5 t -60.75 -44.56 97.6 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.159 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 174.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 29.6 m -58.71 -44.17 90.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.749 178.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -62.77 -37.07 85.17 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.169 0.509 . . . . 0.0 110.763 177.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.03 -44.41 63.44 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.914 -178.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.566 HG23 ' O ' ' A' ' 29' ' ' VAL . 92.9 t -61.38 -42.9 95.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.458 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.5 -36.79 76.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.662 0.268 . . . . 0.0 110.938 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -71.48 -42.95 67.43 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.945 0.402 . . . . 0.0 110.636 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.679 ' HB2' HG11 ' A' ' 70' ' ' VAL . 80.6 mt -66.97 -30.75 70.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.196 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.566 ' HG ' HG12 ' A' ' 70' ' ' VAL . 12.6 mt -85.38 7.49 22.3 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.628 -178.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -81.16 137.98 35.89 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.058 175.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.444 ' HA ' ' HG2' ' A' ' 42' ' ' ARG . 15.8 m -61.53 -36.45 80.61 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.773 -176.366 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.47 ' H ' ' HD2' ' A' ' 40' ' ' ARG . 3.6 mpt_? -70.33 -39.38 74.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.225 0.535 . . . . 0.0 109.66 -179.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.48 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 91.3 t -76.36 -36.78 30.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.603 -177.589 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.444 ' HG2' ' HA ' ' A' ' 39' ' ' SER . 40.2 ptt180 -65.91 -20.18 66.13 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 121.937 -0.477 . . . . 0.0 109.792 176.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 28.2 tpt180 -83.07 -19.03 37.61 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.545 179.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 p -82.4 161.18 60.31 Favored Pre-proline 0 C--N 1.33 -0.241 0 O-C-N 122.144 -0.347 . . . . 0.0 111.081 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -59.94 149.74 82.23 Favored 'Trans proline' 0 C--O 1.237 0.428 0 C-N-CA 122.641 2.227 . . . . 0.0 112.032 176.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.88 -36.39 76.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.247 -177.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.7 p -58.56 -42.61 88.34 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.121 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 52.0 m -62.06 -45.86 91.67 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.065 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.504 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 82.3 mttt -57.09 -49.91 74.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.326 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 81.3 t -63.58 -44.88 98.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.012 -177.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -64.83 -38.69 91.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.306 -177.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -64.63 -47.89 76.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.667 0.27 . . . . 0.0 110.469 178.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 86.1 mt -62.23 -41.05 98.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.203 -178.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.415 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 38.0 tptt -61.57 -42.27 98.6 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 120.923 0.392 . . . . 0.0 110.266 177.46 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.9 m -67.45 -17.33 64.66 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.106 179.262 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.18 -3.59 52.7 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.882 0.372 . . . . 0.0 110.982 177.018 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.24 8.34 47.41 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.922 176.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.531 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 7.4 mp -75.11 157.15 35.18 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.631 0.729 . . . . 0.0 111.821 -179.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.8 m -95.05 160.69 14.45 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.947 172.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.67 -37.69 76.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.897 0.379 . . . . 0.0 111.386 -177.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -70.66 -29.49 65.85 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.438 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -71.37 -44.36 65.16 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.073 0.463 . . . . 0.0 110.233 177.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 60.0 mt -62.49 -42.1 94.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.048 176.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 48.3 t -56.77 -46.29 81.55 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.267 -0.878 . . . . 0.0 110.963 178.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -66.59 -47.53 72.42 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.666 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.24 -42.07 80.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.595 -176.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.416 ' O ' HG22 ' A' ' 70' ' ' VAL . 4.1 m-85 -61.45 -44.96 96.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.088 0.47 . . . . 0.0 110.78 176.391 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.1 m -64.71 -33.63 76.42 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.202 0.525 . . . . 0.0 110.297 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.7 mmmt -62.98 -36.56 83.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.38 178.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.679 HG11 ' HB2' ' A' ' 36' ' ' LEU . 19.7 m -89.61 3.69 6.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -174.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.06 18.42 29.29 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.275 -0.964 . . . . 0.0 112.9 177.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.404 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 5.7 tp-100 -126.77 90.83 48.69 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.202 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -71.6 100.34 1.03 Allowed 'Trans proline' 0 N--CA 1.461 -0.4 0 C-N-CA 121.955 1.77 . . . . 0.0 112.816 -175.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -108.33 146.38 33.05 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.989 176.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 39.1 p -89.37 165.84 14.11 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.593 177.65 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 61.0 tp -63.32 -35.19 79.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.277 0.56 . . . . 0.0 109.599 174.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.95 -40.5 96.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.594 178.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.477 ' O ' HG13 ' A' ' 82' ' ' ILE . 12.5 mm-40 -56.92 -49.27 76.12 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.592 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.5 mm -63.02 -45.44 98.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.742 -176.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -57.63 -42.53 83.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.145 0.497 . . . . 0.0 111.177 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -66.4 -48.02 71.43 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.771 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 78' ' ' GLU . 86.5 mt -62.25 -36.19 73.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.289 -178.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.7 mt -78.09 -25.79 47.76 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.078 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 69.9 m . . . . . 0 C--O 1.249 1.054 0 O-C-N 123.84 0.712 . . . . 0.0 112.288 179.47 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 64.1 pttt . . . . . 0 N--CA 1.48 1.038 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -84.28 27.58 0.6 Allowed 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.7 2.267 . . . . 0.0 112.119 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -111.91 67.97 0.66 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.732 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 38.1 t -95.24 -41.23 11.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 175.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -124.33 117.49 24.61 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.414 -1.266 . . . . 0.0 108.843 175.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.419 ' HB2' ' OG ' ' A' ' 23' ' ' SER . 4.8 p-80 -87.11 77.47 9.1 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.547 0.689 . . . . 0.0 111.849 -175.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.4 p -70.98 -29.88 65.99 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.19 176.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 13.9 m170 -66.38 -37.34 85.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.144 178.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.419 ' OG ' ' HB2' ' A' ' 20' ' ' HIS . 16.8 m -67.2 -35.5 79.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.615 178.503 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.471 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 12.9 tp10 -63.69 -41.45 98.13 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.09 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -66.4 -45.0 81.48 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.173 174.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -57.57 -44.36 85.26 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.29 -178.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -71.1 -40.01 71.75 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.843 179.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.471 ' HG3' ' O ' ' A' ' 24' ' ' GLU . 20.6 mtm180 -58.88 -48.97 79.5 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 120.893 0.378 . . . . 0.0 110.6 177.485 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.561 ' O ' HG23 ' A' ' 33' ' ' VAL . 99.2 t -63.12 -45.15 99.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.192 177.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.1 t -58.58 -45.23 89.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.728 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -62.12 -38.72 89.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.072 0.463 . . . . 0.0 110.768 179.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.23 -43.89 63.71 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.066 179.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 29' ' ' VAL . 69.2 t -60.95 -43.18 95.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.553 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -69.65 -35.45 75.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.724 0.297 . . . . 0.0 111.062 179.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -72.6 -43.13 63.74 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 120.991 0.424 . . . . 0.0 110.908 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.632 ' HB2' HG11 ' A' ' 70' ' ' VAL . 91.5 mt -65.71 -30.41 71.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.847 179.319 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.6 mt -85.82 7.15 25.0 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.526 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -78.76 138.87 38.43 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.835 0.35 . . . . 0.0 110.627 -178.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.605 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 14.9 t -57.87 -35.21 70.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.329 -178.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -69.87 -38.84 76.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.148 0.499 . . . . 0.0 110.984 178.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.6 t -79.39 -27.91 13.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.739 -174.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.605 ' HG2' ' O ' ' A' ' 39' ' ' SER . 39.0 ptt180 -64.13 -21.84 66.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.953 0.406 . . . . 0.0 110.735 178.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -88.27 -17.54 30.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.032 -179.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.8 p -86.01 157.04 57.51 Favored Pre-proline 0 C--N 1.326 -0.43 0 C-N-CA 121.055 -0.258 . . . . 0.0 111.089 179.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.423 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 35.7 Cg_endo -64.88 159.81 44.17 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.718 2.278 . . . . 0.0 112.149 177.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.576 HG21 ' HE3' ' A' ' 74' ' ' LYS . 1.3 m -59.8 -41.53 91.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.024 -178.222 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.459 ' HA ' ' CG2' ' A' ' 82' ' ' ILE . 10.1 m -58.65 -40.56 83.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.34 -176.142 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.6 m -63.57 -42.38 98.33 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 120.719 0.295 . . . . 0.0 110.999 177.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 45' ' ' PRO . 80.8 mttt -59.79 -48.32 82.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.124 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 58.5 t -65.84 -43.22 93.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.887 -177.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 37.1 m170 -62.84 -39.61 94.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.598 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -64.24 -51.08 65.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.554 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 49' ' ' LYS . 94.9 mt -60.55 -38.69 85.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.969 -178.02 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.37 -44.18 97.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.165 0.507 . . . . 0.0 110.152 176.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 18.5 m -64.77 -19.34 65.76 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.445 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -85.22 -1.37 56.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.275 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 96.01 12.71 51.82 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.619 177.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.439 ' HG ' ' HB3' ' A' ' 28' ' ' ARG . 6.6 mp -81.57 152.63 27.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.051 0.453 . . . . 0.0 111.033 177.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.512 ' HB2' ' HG2' ' A' ' 62' ' ' GLU . 17.8 m -95.6 163.97 12.98 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.422 176.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.18 -37.57 75.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.889 0.376 . . . . 0.0 111.349 -177.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -65.01 -40.76 95.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.485 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.512 ' HG2' ' HB2' ' A' ' 59' ' ' SER . 4.6 mm-40 -64.28 -45.1 89.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.309 0.576 . . . . 0.0 109.514 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 76.6 mt -63.03 -45.48 98.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.9 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 48.2 t -56.81 -45.29 82.35 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.298 -179.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -68.13 -47.36 68.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.806 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.13 -41.78 79.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.486 -179.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.418 ' O ' HG22 ' A' ' 70' ' ' VAL . 2.8 m-85 -59.32 -47.97 83.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.946 177.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.0 m -63.98 -32.63 74.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.23 0.538 . . . . 0.0 110.322 -179.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mmmt -65.51 -33.99 77.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.065 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.632 HG11 ' HB2' ' A' ' 36' ' ' LEU . 26.0 m -89.14 5.78 4.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.742 0.306 . . . . 0.0 111.701 -177.256 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.78 22.37 33.73 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.532 -0.842 . . . . 0.0 112.326 178.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -127.36 91.03 47.22 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 175.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -70.1 104.45 1.37 Allowed 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 121.788 1.659 . . . . 0.0 112.168 -177.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.576 ' HE3' HG21 ' A' ' 46' ' ' THR . 72.5 mmtt -115.12 137.52 51.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.318 176.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 73.9 p -81.76 162.3 22.97 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 178.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 55.1 tp -62.39 -33.14 74.18 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.417 0.627 . . . . 0.0 109.41 177.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -61.9 -45.2 94.75 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.553 177.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -59.41 -47.0 87.14 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.038 179.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 43.5 mm -59.53 -46.21 93.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.563 -177.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -64.48 -38.43 90.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.027 0.441 . . . . 0.0 111.192 178.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -66.03 -41.41 90.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.822 178.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.459 ' CG2' ' HA ' ' A' ' 47' ' ' SER . 81.1 mt -67.1 -32.22 56.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.23 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 98.7 mt -78.13 -20.82 51.35 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.051 178.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 12.4 m . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.593 -177.567 . . . . . . . . 0 0 . 1 stop_ save_