data_1hd4_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 1hd4 _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 11' ' ' THR . . . . . 0.751 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 7.1 t . . . . . 0 CA--C 1.518 -0.252 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.664 ' HG ' ' HB2' ' A' ' 79' ' ' HIS . 5.8 mp -111.25 134.72 52.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.753 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.716 ' HG3' ' HA ' ' A' ' 29' ' ' MET . 0.5 OUTLIER -98.26 51.29 1.02 Allowed 'General case' 0 CA--C 1.502 -0.868 0 CA-C-O 121.389 0.614 . . . . 0.0 111.766 -179.385 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.68 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 38.8 tt0 0.33 117.85 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 114.118 -1.401 . . . . 0.0 111.187 -179.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.771 ' HB2' HG23 ' A' ' 25' ' ' ILE . 6.7 t-20 -46.87 115.14 3.17 Favored Pre-proline 0 C--N 1.305 -1.367 0 CA-C-N 114.186 -1.37 . . . . 0.0 112.188 -179.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -80.35 16.44 1.54 Allowed 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.822 2.348 . . . . 0.0 111.262 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.642 ' CE2' ' HE2' ' A' ' 71' ' ' MET . 9.1 t80 -125.04 -55.06 1.6 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.886 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.696 ' CD2' ' CG1' ' A' ' 70' ' ' VAL . 0.4 OUTLIER -73.71 -16.17 61.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.588 179.966 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.585 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 17.1 p -52.98 79.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.524 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.598 ' N ' ' O ' ' A' ' 18' ' ' PHE . 3.3 pt20 -104.03 167.61 9.79 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.145 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -61.17 63.08 0.1 OUTLIER 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.682 2.255 . . . . 0.0 111.683 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.522 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 147.91 -8.65 1.12 Allowed Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.391 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.414 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -147.68 102.95 3.68 Favored Pre-proline 0 CA--C 1.513 -0.442 0 CA-C-O 122.071 0.939 . . . . 0.0 111.996 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.585 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 90.7 Cg_endo -104.14 65.32 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.51 0 C-N-CA 124.923 3.749 . . . . 0.0 112.795 -178.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.978 HG13 HG22 ' A' ' 68' ' ' VAL . 34.3 mm -42.23 -177.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.083 0 CA-C-N 115.198 -0.91 . . . . 0.0 113.444 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.741 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -148.23 -155.77 0.66 Allowed 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -174.719 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.523 ' O ' ' CG ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER 159.93 67.17 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 113.143 -1.844 . . . . 0.0 111.478 179.569 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.751 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.1 OUTLIER 4.8 118.33 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 114.992 -1.004 . . . . 0.0 113.425 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.716 ' HA ' ' HG3' ' A' ' 13' ' ' GLN . 3.9 ttt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.481 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.605 ' O ' ' C ' ' A' ' 62' ' ' ALA . 23.8 t . . . . . 0 N--CA 1.456 -0.159 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.605 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 17.96 95.13 0.0 OUTLIER 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.889 -178.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.899 ' N ' ' O ' ' A' ' 81' ' ' ALA . 21.7 tttm -50.3 -32.84 18.04 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-O 121.648 0.737 . . . . 0.0 109.198 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.642 ' O ' ' N ' ' A' ' 80' ' ' THR . 12.7 m -147.37 105.14 3.71 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.039 179.197 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.765 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 2.9 p90 -91.04 164.63 13.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.486 0.66 . . . . 0.0 112.072 -179.041 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.734 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 3.5 t-20 -135.71 28.95 3.24 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 122.927 1.346 . . . . 0.0 107.823 177.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.549 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -9.86 131.95 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 111.637 -2.529 . . . . 0.0 112.559 -179.48 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.978 HG22 HG13 ' A' ' 25' ' ' ILE . 14.0 m -139.36 52.24 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.323 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.676 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 50.7 m -24.62 118.3 0.05 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.564 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.696 ' CG1' ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -115.92 -168.93 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.499 0.666 . . . . 0.0 112.316 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.642 ' HE2' ' CE2' ' A' ' 17' ' ' PHE . 1.1 mtp 30.44 -137.56 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.711 -1.131 . . . . 0.0 111.034 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -71.55 14.78 1.76 Allowed Glycine 0 N--CA 1.443 -0.833 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.624 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.548 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 123.92 36.78 0.61 Allowed Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.959 -0.639 . . . . 0.0 111.881 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.676 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.7 m-85 -75.16 118.3 17.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.961 0.41 . . . . 0.0 111.096 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.48 ' HB3' ' HD3' ' A' ' 67' ' ' ARG . 0.1 OUTLIER -98.71 124.12 43.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.478 0.656 . . . . 0.0 111.393 -179.526 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.808 ' CG2' ' CG2' ' A' ' 25' ' ' ILE . 27.1 m -117.69 11.67 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.308 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.201 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.765 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.4 OUTLIER 25.81 40.54 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 -177.124 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.734 ' HB3' ' HB3' ' A' ' 66' ' ' ASN . 33.6 t30 -2.97 69.53 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 113.528 -1.669 . . . . 0.0 109.26 -174.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.715 ' HD2' ' O ' ' A' ' 77' ' ' GLU . 40.5 m170 -39.54 120.02 1.03 Allowed 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 113.068 -1.878 . . . . 0.0 113.266 -177.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.642 ' N ' ' O ' ' A' ' 64' ' ' SER . 0.6 OUTLIER -112.52 -5.65 14.02 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 113.425 -1.716 . . . . 0.0 110.325 179.606 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.899 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -171.38 83.9 0.08 Allowed 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.278 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 1.2 m -80.52 127.99 33.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.73 0.3 . . . . 0.0 110.943 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.413 ' HD2' ' N ' ' A' ' 63' ' ' LYS . 5.1 p80 . . . . . 0 C--N 1.333 -0.127 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.322 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.694 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 10.0 t . . . . . 0 CA--C 1.513 -0.449 0 CA-C-O 120.807 0.337 . . . . 0.0 110.495 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.753 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 6.5 mp -81.22 135.37 35.74 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.0 -179.294 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.652 ' O ' ' O ' ' A' ' 14' ' ' GLU . 54.6 mt-30 -118.33 57.53 0.85 Allowed 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.365 179.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.652 ' O ' ' O ' ' A' ' 13' ' ' GLN . 6.1 tt0 7.69 119.87 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.813 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.654 HD21 ' CG2' ' A' ' 25' ' ' ILE . 3.5 t-20 -39.22 128.03 1.3 Allowed Pre-proline 0 C--N 1.309 -1.167 0 CA-C-N 114.337 -1.302 . . . . 0.0 111.837 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.465 ' HD2' ' OD1' ' A' ' 15' ' ' ASN . 94.2 Cg_endo -85.22 31.95 0.48 Allowed 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.65 2.233 . . . . 0.0 111.167 178.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.523 ' CE2' ' HG3' ' A' ' 71' ' ' MET . 22.4 t80 -148.41 -55.75 0.21 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.634 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.695 ' CD2' HG22 ' A' ' 68' ' ' VAL . 0.1 OUTLIER -70.76 -26.0 63.16 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.825 -1.079 . . . . 0.0 110.834 -179.51 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.632 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 35.9 t -50.92 81.09 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.944 -179.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.584 ' N ' ' O ' ' A' ' 18' ' ' PHE . 3.9 mm-40 -122.55 159.01 54.75 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.068 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -51.02 77.52 0.02 OUTLIER 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.748 2.299 . . . . 0.0 111.876 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 138.61 -18.63 3.21 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.601 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.504 ' O ' ' O ' ' A' ' 18' ' ' PHE . . . -147.11 102.76 3.82 Favored Pre-proline 0 CA--C 1.513 -0.475 0 CA-C-O 121.871 0.843 . . . . 0.0 111.782 -179.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.632 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 93.5 Cg_endo -105.89 64.49 0.02 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.564 0 C-N-CA 124.671 3.58 . . . . 0.0 113.603 -178.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.842 HG22 HG23 ' A' ' 76' ' ' VAL . 24.5 mm -43.4 -174.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.051 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.691 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.825 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -151.37 -161.67 1.38 Allowed 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 114.49 1.292 . . . . 0.0 114.49 -175.418 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.493 ' CB ' ' O ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER 159.72 83.51 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 112.809 -1.996 . . . . 0.0 110.9 179.104 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.694 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.0 OUTLIER -27.57 110.5 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.004 -179.405 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.589 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.7 mmt . . . . . 0 C--N 1.33 -0.246 0 CA-C-O 120.902 0.382 . . . . 0.0 111.161 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.553 ' O ' ' C ' ' A' ' 62' ' ' ALA . 9.6 p . . . . . 0 N--CA 1.463 0.18 0 CA-C-O 120.697 0.284 . . . . 0.0 110.604 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.601 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 10.28 110.02 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.511 -179.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.884 ' N ' ' O ' ' A' ' 81' ' ' ALA . 8.2 ttmt -57.01 -42.96 81.3 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.611 0.72 . . . . 0.0 109.088 178.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.531 ' O ' ' N ' ' A' ' 80' ' ' THR . 16.9 m -141.03 128.75 21.57 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.523 -1.217 . . . . 0.0 109.095 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.702 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 4.8 p90 -114.73 157.52 23.07 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -178.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.932 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -125.3 27.97 6.45 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 122.615 1.198 . . . . 0.0 108.219 176.645 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.677 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 4.2 ptp180 -8.35 103.72 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 112.36 -2.2 . . . . 0.0 111.966 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.742 ' CG1' HD13 ' A' ' 25' ' ' ILE . 3.4 m -104.02 45.93 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.393 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.68 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 28.5 m -16.33 119.05 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.63 -178.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.635 HG11 ' CE2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -113.49 -162.8 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.691 179.94 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.523 ' HG3' ' CE2' ' A' ' 17' ' ' PHE . 6.0 mtp -29.13 151.58 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.208 -1.36 . . . . 0.0 111.907 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 43.7 23.87 0.39 Allowed Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.645 -0.788 . . . . 0.0 111.966 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.47 ' C ' HG21 ' A' ' 69' ' ' THR . . . 73.77 28.84 64.25 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.163 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.68 ' O ' ' HA ' ' A' ' 69' ' ' THR . 20.3 m-85 -43.81 170.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.633 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 22.3 mtmt -153.72 93.26 1.65 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.859 0.361 . . . . 0.0 111.318 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.842 HG23 HG22 ' A' ' 25' ' ' ILE . 18.6 m -93.0 15.73 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.489 -1.391 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.764 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.722 ' O ' ' C ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER 23.42 43.72 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 -177.691 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.932 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 12.9 t-20 1.55 75.52 0.0 OUTLIER 'General case' 0 CA--C 1.499 -1.005 0 CA-C-N 114.519 -1.219 . . . . 0.0 108.043 -175.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.753 ' O ' ' CD2' ' A' ' 12' ' ' LEU . 33.6 m170 -49.19 99.58 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.419 0 CA-C-O 122.61 1.195 . . . . 0.0 111.669 -176.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.653 HG21 ' OD1' ' A' ' 78' ' ' ASN . 2.8 p -92.07 -3.5 55.66 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.55 -1.659 . . . . 0.0 109.71 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.884 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -174.33 126.75 0.34 Allowed 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.55 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.5 OUTLIER -121.47 127.91 51.56 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.987 0.422 . . . . 0.0 111.281 -179.21 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.415 ' CD2' ' O ' ' A' ' 83' ' ' HIS . 0.3 OUTLIER . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.788 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.698 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 4.8 t . . . . . 0 CA--C 1.515 -0.387 0 CA-C-O 121.159 0.504 . . . . 0.0 111.021 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.72 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 8.2 mp -75.28 126.34 30.81 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.925 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.586 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.9 mt-30 -104.16 52.81 0.75 Allowed 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.948 179.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.64 ' HG3' ' HB2' ' A' ' 24' ' ' PRO . 2.1 tt0 -1.16 121.87 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.159 -1.837 . . . . 0.0 111.401 -178.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.734 ' HB2' HG23 ' A' ' 25' ' ' ILE . 0.4 OUTLIER -58.68 102.06 0.28 Allowed Pre-proline 0 C--N 1.307 -1.247 0 CA-C-N 114.348 -1.296 . . . . 0.0 112.565 -179.101 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.539 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 2.8 Cg_exo -73.45 2.37 5.8 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.267 1.978 . . . . 0.0 109.084 177.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.527 ' CE1' ' SD ' ' A' ' 71' ' ' MET . 2.1 t80 -93.3 -60.69 1.73 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 113.557 -1.656 . . . . 0.0 110.287 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.723 ' CE1' ' HB ' ' A' ' 70' ' ' VAL . 12.6 m-85 -81.35 -5.79 58.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.044 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.517 ' O ' ' OG ' ' A' ' 19' ' ' SER . 0.0 OUTLIER -52.81 89.15 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.51 179.72 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.553 ' CB ' ' CD ' ' A' ' 21' ' ' PRO . 5.3 pt20 -96.55 -176.38 0.53 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.818 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.553 ' CD ' ' CB ' ' A' ' 20' ' ' GLN . 2.9 Cg_endo -73.86 60.63 4.51 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.522 2.148 . . . . 0.0 111.402 179.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 143.12 3.35 0.9 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.661 -0.78 . . . . 0.0 113.263 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.461 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -154.56 105.82 2.36 Favored Pre-proline 0 CA--C 1.514 -0.405 0 CA-C-O 121.894 0.854 . . . . 0.0 111.808 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.661 ' O ' ' O ' ' A' ' 25' ' ' ILE . 66.6 Cg_endo -103.4 73.08 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.392 0 C-N-CA 124.77 3.647 . . . . 0.0 113.004 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.819 ' CG2' ' H ' ' A' ' 26' ' ' LEU . 6.7 mm -38.52 -177.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.819 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -151.21 -163.66 1.82 Allowed 'General case' 0 CA--C 1.499 -1.013 0 CA-C-O 122.851 1.31 . . . . 0.0 114.262 -175.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.558 ' O ' ' CG ' ' A' ' 27' ' ' GLN . 0.3 OUTLIER 166.27 66.49 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 112.363 -2.198 . . . . 0.0 110.836 179.331 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.698 ' HA ' ' O ' ' A' ' 11' ' ' THR . 3.9 t -24.73 109.26 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.223 -179.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.515 ' HG2' ' OE1' ' A' ' 13' ' ' GLN . 3.4 ttm . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.078 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.569 ' O ' ' O ' ' A' ' 62' ' ' ALA . 40.1 t . . . . . 0 N--CA 1.461 0.078 0 CA-C-O 120.763 0.316 . . . . 0.0 110.979 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.569 ' O ' ' O ' ' A' ' 61' ' ' VAL . . . 16.83 112.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.634 ' N ' ' O ' ' A' ' 81' ' ' ALA . 20.2 ttmt -54.16 -33.61 58.41 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.471 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 1.8 m -137.27 -175.32 4.02 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.964 178.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.683 ' HB3' ' HB3' ' A' ' 77' ' ' GLU . 1.0 OUTLIER -164.6 162.06 21.34 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.288 0.566 . . . . 0.0 111.588 -179.77 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.668 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -132.54 27.66 4.36 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.194 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.587 ' CG ' ' HA ' ' A' ' 77' ' ' GLU . 2.4 ttm105 -8.05 121.4 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 112.284 -2.235 . . . . 0.0 111.311 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.738 HG22 HG13 ' A' ' 25' ' ' ILE . 4.3 m -123.72 43.62 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.803 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.64 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 54.5 m -17.82 118.35 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.764 -178.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.723 ' HB ' ' CE1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -122.25 -169.79 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.485 -179.054 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.613 ' HG3' ' CG ' ' A' ' 74' ' ' PHE . 0.1 OUTLIER 41.54 -140.09 0.12 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.368 -179.59 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -70.63 0.34 27.68 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.811 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.429 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 136.11 40.94 0.13 Allowed Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.525 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.663 ' C ' ' HG2' ' A' ' 75' ' ' LYS . 2.4 m-85 -69.41 -179.33 1.62 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.663 ' HG2' ' C ' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -157.45 97.58 1.62 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.984 0.365 . . . . 0.0 111.984 -179.466 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.809 HG22 HG21 ' A' ' 25' ' ' ILE . 16.3 m -91.62 11.93 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.42 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.013 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.755 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 29.22 39.56 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 105.083 -2.192 . . . . 0.0 105.083 -176.601 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.687 ' N ' ' O ' ' A' ' 76' ' ' VAL . 32.7 t30 -0.14 65.45 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 112.816 -1.993 . . . . 0.0 108.378 -174.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.755 ' N ' ' O ' ' A' ' 77' ' ' GLU . 37.8 m170 -34.46 123.58 0.52 Allowed 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 112.703 -2.044 . . . . 0.0 113.43 -176.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.543 HG21 ' O ' ' A' ' 78' ' ' ASN . 6.5 p -110.78 -15.14 13.88 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 113.471 -1.695 . . . . 0.0 110.426 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.634 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -161.87 147.65 13.47 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.888 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.5 OUTLIER -127.27 154.55 44.75 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.904 0.383 . . . . 0.0 111.227 -179.98 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.438 ' CD2' ' O ' ' A' ' 83' ' ' HIS . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.943 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.689 ' O ' ' N ' ' A' ' 29' ' ' MET . 3.3 t . . . . . 0 CA--C 1.512 -0.489 0 CA-C-O 121.101 0.477 . . . . 0.0 110.37 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.631 ' CD2' ' HB2' ' A' ' 79' ' ' HIS . 7.8 mp -75.74 133.66 40.68 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.274 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.713 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.7 mt-30 -120.75 65.12 0.85 Allowed 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 121.636 0.731 . . . . 0.0 110.977 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.713 ' O ' ' O ' ' A' ' 13' ' ' GLN . 18.2 tt0 2.91 127.22 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 113.566 -1.652 . . . . 0.0 111.903 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.772 ' CG ' HG13 ' A' ' 76' ' ' VAL . 1.3 t30 -56.19 108.82 1.32 Allowed Pre-proline 0 C--N 1.307 -1.28 0 CA-C-N 113.858 -1.519 . . . . 0.0 113.339 -178.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.737 ' HD2' ' CE1' ' A' ' 17' ' ' PHE . 9.9 Cg_exo -69.95 4.95 1.97 Allowed 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.508 2.139 . . . . 0.0 112.042 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.741 ' CZ ' ' OD1' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -114.12 -56.16 2.42 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.394 178.674 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.722 ' HB3' ' CG1' ' A' ' 25' ' ' ILE . 0.3 OUTLIER -78.97 -5.58 54.18 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.888 -178.751 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.468 ' CB ' ' O ' ' A' ' 15' ' ' ASN . 2.2 t -64.91 95.28 0.15 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.746 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.575 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.1 OUTLIER -135.84 144.74 49.92 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.857 -179.649 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.562 ' CD ' ' HG3' ' A' ' 20' ' ' GLN . 1.3 Cg_endo -45.1 82.91 0.01 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.7 2.267 . . . . 0.0 111.343 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.575 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 138.35 -15.87 3.41 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.73 -179.088 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.444 ' O ' ' O ' ' A' ' 18' ' ' PHE . . . -153.95 100.28 2.53 Favored Pre-proline 0 CA--C 1.51 -0.587 0 CA-C-O 121.958 0.885 . . . . 0.0 111.094 179.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.662 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.1 Cg_endo -103.26 60.33 0.02 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.588 0 C-N-CA 124.643 3.562 . . . . 0.0 112.78 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.917 HG13 HG22 ' A' ' 68' ' ' VAL . 23.1 mm -40.25 -176.69 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.141 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.876 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.782 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -148.87 -160.16 1.13 Allowed 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -175.105 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.476 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER 161.8 98.17 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 112.376 -2.193 . . . . 0.0 109.723 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.628 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -48.29 103.65 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.492 -0.777 . . . . 0.0 111.711 -178.531 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.689 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.47 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.624 ' O ' ' C ' ' A' ' 62' ' ' ALA . 47.8 t . . . . . 0 N--CA 1.456 -0.131 0 CA-C-O 120.559 0.219 . . . . 0.0 110.713 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.624 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 0.3 103.36 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.696 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.791 ' N ' ' O ' ' A' ' 81' ' ' ALA . 1.6 ttmm -54.84 -38.74 67.81 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.545 ' O ' ' N ' ' A' ' 80' ' ' THR . 15.5 m -140.94 117.0 10.52 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.779 -1.101 . . . . 0.0 109.717 178.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.71 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 2.8 p90 -107.57 161.99 14.36 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.283 -178.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.811 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 1.0 OUTLIER -129.69 28.13 5.16 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 122.357 1.075 . . . . 0.0 108.173 177.11 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.721 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -11.85 115.81 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 112.565 -2.107 . . . . 0.0 111.734 -179.899 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.917 HG22 HG13 ' A' ' 25' ' ' ILE . 3.8 m -120.14 48.12 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 114.867 -1.06 . . . . 0.0 110.737 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.637 ' C ' ' O ' ' A' ' 68' ' ' VAL . 5.8 m -14.05 118.84 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.079 -179.062 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.671 ' CG1' ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -107.52 -162.42 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.799 0.809 . . . . 0.0 111.729 -179.8 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.539 ' O ' ' CD1' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -32.66 151.45 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.929 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 48.01 19.23 0.95 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.15 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.521 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 70.82 30.26 68.41 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.303 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.58 ' O ' ' HA ' ' A' ' 69' ' ' THR . 5.8 m-30 -51.67 -174.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.803 0.335 . . . . 0.0 111.007 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -158.97 121.05 3.49 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.274 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.812 HG22 HG21 ' A' ' 25' ' ' ILE . 19.6 m -118.18 12.08 7.11 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.494 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.437 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.724 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 28.26 39.71 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 -177.05 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.811 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 49.2 t30 -0.8 68.49 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.899 0 CA-C-N 113.531 -1.668 . . . . 0.0 108.55 -174.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.724 ' N ' ' O ' ' A' ' 77' ' ' GLU . 39.4 m170 -39.48 118.01 0.78 Allowed 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 113.198 -1.819 . . . . 0.0 114.1 -176.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.64 HG21 ' O ' ' A' ' 78' ' ' ASN . 1.0 OUTLIER -109.12 -17.01 13.98 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 113.379 -1.737 . . . . 0.0 109.487 178.792 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.791 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -162.88 136.93 6.19 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.263 -0.88 . . . . 0.0 108.942 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -125.9 140.98 52.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.706 0.289 . . . . 0.0 110.636 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.331 -0.216 0 CA-C-O 120.98 0.419 . . . . 0.0 111.502 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.614 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 1.0 OUTLIER . . . . . 0 N--CA 1.456 -0.139 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.66 ' HG ' ' HB2' ' A' ' 79' ' ' HIS . 6.1 mp -122.27 138.19 54.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.154 0.502 . . . . 0.0 111.093 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.63 ' O ' ' C ' ' A' ' 14' ' ' GLU . 1.6 mt-30 -96.15 44.97 1.07 Allowed 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.197 -179.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.668 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 21.8 tt0 -2.53 116.63 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 114.143 -1.389 . . . . 0.0 110.66 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.757 ' HB2' HG23 ' A' ' 25' ' ' ILE . 0.9 OUTLIER -56.03 103.1 0.34 Allowed Pre-proline 0 C--N 1.304 -1.4 0 CA-C-N 114.223 -1.353 . . . . 0.0 112.367 -178.8 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.552 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 72.6 Cg_endo -75.37 10.27 1.89 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.247 1.965 . . . . 0.0 109.887 177.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.576 ' CZ ' ' SD ' ' A' ' 71' ' ' MET . 0.8 OUTLIER -106.06 -59.55 1.76 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.212 -1.358 . . . . 0.0 110.879 -179.478 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.723 ' CG ' HG22 ' A' ' 70' ' ' VAL . 8.8 m-85 -80.34 -1.71 42.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.822 -179.032 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.442 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 27.4 t -48.94 93.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.841 0.353 . . . . 0.0 110.179 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.543 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.1 OUTLIER -91.43 168.38 13.56 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.921 -179.566 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.407 ' CD ' ' HB3' ' A' ' 20' ' ' GLN . 27.2 Cg_exo -62.55 59.69 0.14 Allowed 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.708 2.272 . . . . 0.0 111.462 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.543 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 138.62 5.21 1.51 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.898 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.412 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -150.98 101.69 3.02 Favored Pre-proline 0 CA--C 1.511 -0.543 0 CA-C-O 122.082 0.944 . . . . 0.0 111.938 -179.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.64 ' O ' HD22 ' A' ' 26' ' ' LEU . 18.6 Cg_endo -96.17 81.24 0.1 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.464 0 C-N-CA 124.504 3.469 . . . . 0.0 112.708 -179.279 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.832 ' CG2' ' H ' ' A' ' 26' ' ' LEU . 12.6 mm -42.01 -175.59 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.832 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -153.72 -160.37 1.1 Allowed 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 -175.229 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.539 ' O ' ' O ' ' A' ' 28' ' ' CYS . 1.8 tt0 162.53 64.06 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 112.523 -2.126 . . . . 0.0 111.429 179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.63 ' HB2' ' ND1' ' A' ' 79' ' ' HIS . 0.6 OUTLIER 6.91 121.0 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 179.772 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.596 ' HA ' ' CG ' ' A' ' 13' ' ' GLN . 3.2 ttp . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.904 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.53 ' O ' ' O ' ' A' ' 62' ' ' ALA . 73.2 t . . . . . 0 N--CA 1.456 -0.149 0 CA-C-O 121.021 0.438 . . . . 0.0 110.027 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.557 ' HA ' ' O ' ' A' ' 81' ' ' ALA . . . 31.87 103.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.891 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.768 ' N ' ' O ' ' A' ' 81' ' ' ALA . 3.1 tptt -51.92 -36.33 48.63 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.706 0.765 . . . . 0.0 109.23 178.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.612 ' O ' ' N ' ' A' ' 80' ' ' THR . 74.9 m -150.08 118.84 6.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.39 -1.277 . . . . 0.0 109.919 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.798 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -105.23 166.31 10.5 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.531 0.681 . . . . 0.0 112.293 -178.811 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.761 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 0.1 OUTLIER -130.9 27.09 4.93 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-O 122.593 1.187 . . . . 0.0 107.921 177.399 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.688 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 12.9 ptt85 -11.0 100.7 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 112.475 -2.148 . . . . 0.0 111.689 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.707 HG23 ' CD1' ' A' ' 25' ' ' ILE . 4.2 m -98.32 45.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 CA-C-N 114.939 -1.028 . . . . 0.0 110.502 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.656 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 53.0 m -21.52 118.9 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.027 -179.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.723 HG22 ' CG ' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -126.12 -167.49 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.784 0.802 . . . . 0.0 112.474 -178.457 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.601 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 0.0 OUTLIER 39.17 -132.73 0.18 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.969 -179.888 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -78.97 19.65 5.13 Favored Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.735 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 113.06 41.43 0.98 Allowed Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.634 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.656 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.2 m-85 -72.53 178.6 3.96 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.585 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 5.9 mtmm -155.14 108.23 2.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.193 0.521 . . . . 0.0 111.454 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.822 HG23 HG22 ' A' ' 25' ' ' ILE . 15.4 m -106.59 15.02 7.52 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.483 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.337 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.798 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.6 OUTLIER 28.41 40.21 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 105.787 -1.931 . . . . 0.0 105.787 -176.876 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.761 ' HB3' ' HB3' ' A' ' 66' ' ' ASN . 29.1 t30 -4.89 68.92 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 113.402 -1.726 . . . . 0.0 108.722 -174.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.787 ' N ' ' O ' ' A' ' 77' ' ' GLU . 36.4 m170 -37.77 122.11 0.95 Allowed 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 112.945 -1.934 . . . . 0.0 113.909 -176.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.612 ' N ' ' O ' ' A' ' 64' ' ' SER . 2.1 p -109.12 -11.73 14.9 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 113.048 -1.887 . . . . 0.0 109.211 178.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.768 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -172.38 142.49 1.31 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.4 179.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 8.1 m -120.82 146.22 46.78 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.679 0.276 . . . . 0.0 110.494 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.331 -0.224 0 CA-C-O 120.816 0.341 . . . . 0.0 111.8 -179.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.625 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 3.9 t . . . . . 0 CA--C 1.516 -0.36 0 CA-C-O 121.183 0.516 . . . . 0.0 111.106 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.912 HD22 ' O ' ' A' ' 79' ' ' HIS . 8.0 mp -85.9 130.31 34.58 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.465 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.614 ' O ' ' C ' ' A' ' 14' ' ' GLU . 2.0 mt-30 -91.39 49.01 1.54 Allowed 'General case' 0 CA--C 1.5 -0.95 0 CA-C-O 121.905 0.86 . . . . 0.0 110.278 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.614 ' C ' ' O ' ' A' ' 13' ' ' GLN . 27.5 tt0 -1.15 113.81 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 113.339 -1.755 . . . . 0.0 110.864 -178.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.723 ' HB2' HG23 ' A' ' 25' ' ' ILE . 1.4 t-20 -41.0 100.69 0.23 Allowed Pre-proline 0 C--N 1.301 -1.528 0 CA-C-N 113.293 -1.776 . . . . 0.0 112.349 -179.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -68.74 4.83 1.56 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.272 1.981 . . . . 0.0 110.664 178.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.587 ' CZ ' ' HG3' ' A' ' 71' ' ' MET . 10.9 t80 -110.63 -56.47 2.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.965 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.641 ' CG ' HG13 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -73.16 -26.53 61.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.535 179.777 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.514 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 8.9 m -47.26 97.57 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.928 -179.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.627 ' O ' ' N ' ' A' ' 22' ' ' GLY . 8.7 tt0 -136.04 139.7 31.01 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.443 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.501 ' HD2' ' HG3' ' A' ' 20' ' ' GLN . 87.9 Cg_exo -35.36 81.84 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.747 2.298 . . . . 0.0 112.417 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.627 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 130.93 -6.32 5.76 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.503 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.456 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . -159.73 101.65 1.47 Allowed Pre-proline 0 CA--C 1.513 -0.463 0 CA-C-O 121.992 0.901 . . . . 0.0 111.862 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.641 ' O ' ' O ' ' A' ' 25' ' ' ILE . 91.6 Cg_endo -106.24 65.94 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.506 0 C-N-CA 124.981 3.787 . . . . 0.0 113.469 -178.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.798 HG21 HG22 ' A' ' 76' ' ' VAL . 16.2 mm -41.81 -176.41 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.368 179.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.792 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -150.62 -160.52 1.18 Allowed 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -175.403 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 17.5 tt0 166.25 63.01 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 112.706 -2.043 . . . . 0.0 110.998 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.625 ' HA ' ' O ' ' A' ' 11' ' ' THR . 94.3 m -20.1 111.73 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.733 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.534 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.927 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.518 ' O ' ' C ' ' A' ' 62' ' ' ALA . 18.0 t . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.974 0.416 . . . . 0.0 110.342 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.556 ' HA ' ' O ' ' A' ' 81' ' ' ALA . . . 13.0 99.65 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -179.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.925 ' N ' ' O ' ' A' ' 81' ' ' ALA . 0.9 OUTLIER -50.29 -35.24 26.5 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.307 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.491 ' CB ' ' OG1' ' A' ' 80' ' ' THR . 22.6 m -136.28 -174.88 3.81 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 113.768 -1.56 . . . . 0.0 108.877 179.164 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.707 ' HB3' ' HB3' ' A' ' 77' ' ' GLU . 1.8 p90 -164.05 162.97 23.38 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.498 0.666 . . . . 0.0 112.331 -179.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.819 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -134.99 29.36 3.43 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 176.468 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.715 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 1.8 ptt85 -10.76 130.0 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 112.109 -2.314 . . . . 0.0 112.368 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.768 HG22 HG13 ' A' ' 25' ' ' ILE . 2.5 m -135.28 38.2 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.094 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.587 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 23.1 m -4.5 119.23 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.661 -1.154 . . . . 0.0 112.336 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.637 HG11 ' CE2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -111.16 -161.29 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-O 121.78 0.8 . . . . 0.0 111.593 179.108 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.587 ' HG3' ' CZ ' ' A' ' 17' ' ' PHE . 3.7 mtt -30.89 153.6 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.901 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 42.13 25.85 0.29 Allowed Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.46 -0.876 . . . . 0.0 111.552 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.495 ' O ' ' O ' ' A' ' 74' ' ' PHE . . . 68.96 30.82 72.22 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.128 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.587 ' O ' ' HA ' ' A' ' 69' ' ' THR . 8.0 m-30 -46.59 179.36 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.625 0.25 . . . . 0.0 110.331 179.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.53 ' CG ' ' O ' ' A' ' 74' ' ' PHE . 9.7 mtpt -161.58 93.0 0.9 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.133 0.492 . . . . 0.0 111.432 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.798 HG22 HG21 ' A' ' 25' ' ' ILE . 27.3 m -85.82 9.1 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.486 -1.488 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.903 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.738 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 29.49 39.62 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 -177.084 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.819 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 61.3 t30 3.91 62.15 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 113.123 -1.853 . . . . 0.0 108.448 -174.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.912 ' O ' HD22 ' A' ' 12' ' ' LEU . 35.7 m170 -31.7 120.95 0.27 Allowed 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 112.778 -2.01 . . . . 0.0 113.7 -176.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.491 ' OG1' ' CB ' ' A' ' 64' ' ' SER . 7.5 p -107.7 -10.88 15.53 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 113.84 -1.527 . . . . 0.0 110.1 179.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.925 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -170.44 133.03 1.02 Allowed 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.908 178.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.594 ' SG ' ' CD1' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -116.67 142.38 46.97 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.27 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.469 ' O ' ' CG ' ' A' ' 83' ' ' HIS . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-O 120.816 0.341 . . . . 0.0 110.828 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.63 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 3.7 t . . . . . 0 CA--C 1.515 -0.382 0 CA-C-O 120.705 0.288 . . . . 0.0 110.419 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.652 ' CD2' ' HB2' ' A' ' 79' ' ' HIS . 3.9 mp -97.2 139.21 33.51 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.392 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.634 ' O ' ' O ' ' A' ' 14' ' ' GLU . 28.7 mt-30 -111.24 55.04 0.66 Allowed 'General case' 0 CA--C 1.505 -0.752 0 CA-C-O 121.658 0.742 . . . . 0.0 110.736 179.093 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.634 ' O ' ' O ' ' A' ' 13' ' ' GLN . 14.7 tt0 -0.16 122.63 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 113.651 -1.613 . . . . 0.0 111.311 -179.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.833 ' HB2' HG23 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -63.46 102.69 0.34 Allowed Pre-proline 0 C--N 1.305 -1.341 0 CA-C-N 114.107 -1.406 . . . . 0.0 112.7 -179.015 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.552 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 6.3 Cg_exo -76.72 5.09 5.08 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.632 2.221 . . . . 0.0 109.41 177.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.503 ' HB3' ' OD1' ' A' ' 15' ' ' ASN . 0.9 OUTLIER -96.85 -62.28 1.28 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 113.86 -1.518 . . . . 0.0 110.525 -179.668 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.677 ' CD2' ' CG ' ' A' ' 15' ' ' ASN . 7.3 m-85 -77.76 -4.86 48.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.86 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.484 ' HA ' ' O ' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -52.23 91.52 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.127 179.477 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.673 ' O ' ' N ' ' A' ' 22' ' ' GLY . 4.6 mt-30 -95.09 162.59 24.39 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.357 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.576 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 11.4 Cg_endo -54.86 63.48 0.03 OUTLIER 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.761 2.307 . . . . 0.0 111.802 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.673 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 143.53 1.08 1.07 Allowed Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.805 -0.712 . . . . 0.0 113.133 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.484 ' O ' ' HA ' ' A' ' 19' ' ' SER . . . -155.13 108.61 2.27 Favored Pre-proline 0 CA--C 1.518 -0.258 0 CA-C-O 122.074 0.94 . . . . 0.0 112.804 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.541 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 94.9 Cg_endo -98.78 78.52 0.05 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.073 0 C-N-CA 124.844 3.696 . . . . 0.0 112.913 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.862 HG21 ' H ' ' A' ' 26' ' ' LEU . 5.1 mm -43.9 -176.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.862 ' H ' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.21 -164.87 2.07 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 122.343 1.068 . . . . 0.0 113.612 -176.297 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.654 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER 165.55 78.87 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 112.939 -1.937 . . . . 0.0 111.051 178.868 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.63 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -13.35 114.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.265 -179.851 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.589 ' N ' ' O ' ' A' ' 11' ' ' THR . 9.8 mmm . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 120.885 0.374 . . . . 0.0 111.241 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.527 ' O ' ' C ' ' A' ' 62' ' ' ALA . 61.0 t . . . . . 0 C--O 1.23 0.053 0 CA-C-O 120.723 0.297 . . . . 0.0 110.738 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.527 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 21.15 103.43 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.992 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.86 ' N ' ' O ' ' A' ' 81' ' ' ALA . 15.1 tttt -54.18 -35.67 62.58 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.538 0.685 . . . . 0.0 109.335 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.537 ' O ' ' N ' ' A' ' 80' ' ' THR . 37.1 m -146.3 127.41 14.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.379 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.798 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -112.31 166.11 11.58 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.594 0.711 . . . . 0.0 112.576 -178.343 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.708 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -133.1 29.52 4.04 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 114.612 -1.176 . . . . 0.0 108.198 177.393 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.72 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.8 OUTLIER -16.13 125.31 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 112.426 -2.17 . . . . 0.0 111.6 -179.718 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.772 ' O ' HG21 ' A' ' 68' ' ' VAL . 2.7 m -128.57 41.92 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.328 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.65 ' C ' ' O ' ' A' ' 68' ' ' VAL . 55.0 m -9.75 118.35 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.665 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.673 ' CG2' ' CD1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -124.45 -171.1 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 121.52 0.676 . . . . 0.0 111.962 -178.765 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.466 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 42.6 mmm 34.3 -127.65 0.08 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.829 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -81.69 26.27 3.69 Favored Glycine 0 N--CA 1.44 -1.057 0 CA-C-N 115.498 -0.774 . . . . 0.0 112.566 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.598 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 104.69 43.02 1.74 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.468 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.612 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.0 m-85 -85.79 116.1 23.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.811 0.339 . . . . 0.0 111.011 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -99.65 104.5 16.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.121 0.486 . . . . 0.0 112.243 -179.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.828 ' CG2' ' CG2' ' A' ' 25' ' ' ILE . 12.6 m -92.32 14.64 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.361 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.755 178.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.798 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 29.18 39.94 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 105.508 -2.034 . . . . 0.0 105.508 -176.426 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.708 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 46.6 t30 -2.2 67.9 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.828 0 CA-C-N 113.245 -1.798 . . . . 0.0 108.53 -175.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.744 ' N ' ' O ' ' A' ' 77' ' ' GLU . 37.6 m170 -35.49 120.48 0.56 Allowed 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 113.264 -1.789 . . . . 0.0 113.877 -176.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.537 ' N ' ' O ' ' A' ' 64' ' ' SER . 3.9 p -111.16 -11.16 14.27 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 113.514 -1.675 . . . . 0.0 110.233 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.86 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -168.83 133.4 1.54 Allowed 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 1.3 m -119.74 137.16 54.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.919 0.39 . . . . 0.0 111.077 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.563 ' CD2' ' O ' ' A' ' 83' ' ' HIS . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.9 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.753 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 1.7 t . . . . . 0 CA--C 1.517 -0.29 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.772 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 6.8 mp -98.32 138.69 35.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.015 0.436 . . . . 0.0 111.812 -179.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.707 ' O ' ' O ' ' A' ' 14' ' ' GLU . 20.2 mt-30 -115.14 52.28 0.87 Allowed 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 121.713 0.768 . . . . 0.0 110.79 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.707 ' O ' ' O ' ' A' ' 13' ' ' GLN . 8.3 tt0 7.7 126.35 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 113.327 -1.76 . . . . 0.0 112.336 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.667 ' HB2' HG23 ' A' ' 25' ' ' ILE . 1.4 t-20 -53.81 108.74 1.2 Allowed Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.249 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -74.12 20.71 0.4 Allowed 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.22 1.947 . . . . 0.0 111.727 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.593 ' CZ ' ' HG2' ' A' ' 71' ' ' MET . 34.8 t80 -128.34 -55.4 1.25 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.58 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.713 ' CD2' ' CG1' ' A' ' 70' ' ' VAL . 0.1 OUTLIER -71.69 -24.34 61.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.685 -179.772 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.642 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.2 m -40.03 92.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.182 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.607 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -124.29 138.89 31.68 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.592 -179.394 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.508 ' N ' ' OE1' ' A' ' 20' ' ' GLN . 83.4 Cg_exo -37.41 83.67 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.534 2.156 . . . . 0.0 112.08 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.607 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 127.37 -9.59 6.94 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.537 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.454 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -154.75 99.48 2.41 Favored Pre-proline 0 CA--C 1.512 -0.508 0 CA-C-O 122.011 0.91 . . . . 0.0 111.486 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.7 ' O ' ' O ' ' A' ' 25' ' ' ILE . 71.7 Cg_endo -103.63 66.67 0.03 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.57 0 C-N-CA 124.954 3.769 . . . . 0.0 112.608 -178.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.9 HG13 HG22 ' A' ' 68' ' ' VAL . 25.1 mm -37.59 -178.03 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.002 0 CA-C-N 115.322 -0.853 . . . . 0.0 113.284 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.777 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -153.78 -159.57 0.99 Allowed 'General case' 0 CA--C 1.498 -1.054 0 CA-C-O 122.726 1.25 . . . . 0.0 114.193 -175.343 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.598 ' O ' ' C ' ' A' ' 28' ' ' CYS . 0.8 OUTLIER 168.58 65.85 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 112.716 -2.038 . . . . 0.0 111.297 179.13 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.753 ' HA ' ' O ' ' A' ' 11' ' ' THR . 68.0 m -5.98 113.04 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.935 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.616 ' N ' ' O ' ' A' ' 11' ' ' THR . 3.3 tpp . . . . . 0 C--N 1.326 -0.444 0 CA-C-O 120.84 0.352 . . . . 0.0 111.226 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.565 ' O ' ' O ' ' A' ' 62' ' ' ALA . 32.5 t . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.975 0.416 . . . . 0.0 111.478 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.629 ' HB3' ' CG ' ' A' ' 79' ' ' HIS . . . 40.23 114.49 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.661 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.753 ' N ' ' O ' ' A' ' 81' ' ' ALA . 13.1 tttm -56.08 -37.1 68.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.52 0.676 . . . . 0.0 109.179 178.012 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.648 ' O ' ' N ' ' A' ' 80' ' ' THR . 70.7 m -143.71 117.51 9.31 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.379 179.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.712 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 2.5 p90 -106.35 162.4 13.71 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.836 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -132.95 27.82 4.22 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 107.613 -1.255 . . . . 0.0 107.613 176.67 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.67 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.2 OUTLIER -6.64 129.69 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 112.201 -2.272 . . . . 0.0 112.522 -179.424 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.9 HG22 HG13 ' A' ' 25' ' ' ILE . 4.9 m -138.76 53.31 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 114.585 -1.188 . . . . 0.0 110.302 179.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.654 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 17.7 m -24.91 118.22 0.05 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.182 0.515 . . . . 0.0 111.466 -178.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.713 ' CG1' ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -109.82 -171.21 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.283 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.593 ' HG2' ' CZ ' ' A' ' 17' ' ' PHE . 3.0 mtp 30.23 -149.68 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.51 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.448 ' H ' ' HB3' ' A' ' 71' ' ' MET . . . -46.76 -20.39 0.65 Allowed Glycine 0 N--CA 1.438 -1.181 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.822 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.573 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 152.78 32.41 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.665 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.654 ' O ' ' HA ' ' A' ' 69' ' ' THR . 9.1 m-30 -53.09 179.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.53 0.205 . . . . 0.0 110.81 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -155.0 103.4 2.39 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.883 0.373 . . . . 0.0 111.184 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.782 HG22 HG21 ' A' ' 25' ' ' ILE . 27.4 m -100.49 10.94 7.19 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.034 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.712 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 27.87 40.35 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 105.384 -2.08 . . . . 0.0 105.384 -177.092 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.836 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 48.0 t30 3.26 64.58 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 113.253 -1.794 . . . . 0.0 108.593 -174.022 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.772 ' O ' ' CD2' ' A' ' 12' ' ' LEU . 37.8 m170 -38.07 120.4 0.86 Allowed 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 112.779 -2.01 . . . . 0.0 113.154 -176.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.648 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.0 OUTLIER -110.19 -7.52 14.86 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 113.533 -1.667 . . . . 0.0 109.466 179.455 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.753 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -173.76 142.2 0.89 Allowed 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.253 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.651 ' SG ' ' CD1' ' A' ' 12' ' ' LEU . 3.2 m -115.93 163.13 16.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.305 0.574 . . . . 0.0 111.457 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.519 ' O ' ' CG ' ' A' ' 83' ' ' HIS . 6.1 p80 . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.128 179.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.715 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 0.6 OUTLIER . . . . . 0 CA--C 1.517 -0.311 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.644 ' HA ' ' HA ' ' A' ' 28' ' ' CYS . 10.8 mp -90.2 128.37 36.35 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.164 0.507 . . . . 0.0 111.59 -179.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.619 ' O ' ' C ' ' A' ' 14' ' ' GLU . 5.0 mt-30 -96.52 46.96 1.06 Allowed 'General case' 0 CA--C 1.502 -0.867 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.775 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.786 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -0.29 117.1 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 113.775 -1.557 . . . . 0.0 110.797 -179.138 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.741 ' HB2' HG23 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -54.88 101.96 0.28 Allowed Pre-proline 0 C--N 1.31 -1.119 0 CA-C-N 114.552 -1.204 . . . . 0.0 112.413 -178.637 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.588 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 61.8 Cg_endo -73.67 7.41 2.34 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 122.091 1.861 . . . . 0.0 110.003 177.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.52 ' HB3' ' OD1' ' A' ' 15' ' ' ASN . 1.5 t80 -102.81 -60.7 1.5 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.191 -1.368 . . . . 0.0 110.102 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.641 ' CD1' HG13 ' A' ' 70' ' ' VAL . 3.2 m-85 -82.93 3.76 28.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.459 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.778 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 15.0 t -64.07 99.11 0.24 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.558 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.627 ' N ' ' O ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -102.26 170.33 6.5 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.991 179.046 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.499 ' HD2' ' CB ' ' A' ' 20' ' ' GLN . 14.7 Cg_endo -57.45 73.12 0.04 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 122.454 2.103 . . . . 0.0 111.94 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 133.79 -9.61 4.89 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.359 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.627 ' O ' ' N ' ' A' ' 20' ' ' GLN . . . -146.12 104.0 4.11 Favored Pre-proline 0 CA--C 1.509 -0.6 0 CA-C-O 121.81 0.815 . . . . 0.0 111.247 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.864 ' O ' ' O ' ' A' ' 25' ' ' ILE . 78.3 Cg_endo -97.06 25.39 0.25 Allowed 'Trans proline' 0 N--CA 1.449 -1.133 0 C-N-CA 124.46 3.44 . . . . 0.0 113.477 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.926 ' C ' ' HG ' ' A' ' 26' ' ' LEU . 10.7 mm 21.94 -175.03 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 114.932 -1.031 . . . . 0.0 112.843 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.926 ' HG ' ' C ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -158.76 -166.08 1.79 Allowed 'General case' 0 CA--C 1.498 -1.043 0 N-CA-C 115.656 1.725 . . . . 0.0 115.656 -174.743 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.558 ' O ' ' CG ' ' A' ' 27' ' ' GLN . 0.5 OUTLIER 166.54 66.99 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 111.561 -2.563 . . . . 0.0 110.75 179.642 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.77 ' HB2' ' HD1' ' A' ' 79' ' ' HIS . 0.1 OUTLIER -19.1 116.07 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.485 -0.779 . . . . 0.0 112.117 -179.089 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.55 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.275 179.271 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.579 ' O ' ' CD2' ' A' ' 83' ' ' HIS . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.07 0 CA-C-O 120.852 0.358 . . . . 0.0 110.52 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.579 ' HA ' ' O ' ' A' ' 81' ' ' ALA . . . 4.2 101.5 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.745 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.786 ' N ' ' O ' ' A' ' 81' ' ' ALA . 0.1 OUTLIER -54.4 -33.48 59.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.502 0.668 . . . . 0.0 109.749 178.291 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.48 ' O ' ' N ' ' A' ' 80' ' ' THR . 17.2 m -151.46 125.88 9.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.843 -1.072 . . . . 0.0 109.744 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.851 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.3 OUTLIER -106.33 163.94 12.43 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.278 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.771 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.9 OUTLIER -130.34 27.45 5.05 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 177.243 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.694 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 3.9 ptt-85 -12.39 99.81 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 112.515 -2.13 . . . . 0.0 111.623 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.66 ' CG2' ' CD1' ' A' ' 25' ' ' ILE . 8.2 m -97.61 45.9 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 CA-C-N 114.683 -1.144 . . . . 0.0 109.837 179.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.62 ' C ' ' O ' ' A' ' 68' ' ' VAL . 28.8 m -14.65 117.58 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.969 -178.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.641 HG13 ' CD1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -114.06 -162.43 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 121.768 0.794 . . . . 0.0 111.996 -179.604 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.635 ' O ' ' CD2' ' A' ' 74' ' ' PHE . 9.2 mtm -21.25 143.17 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 113.855 -1.52 . . . . 0.0 112.716 -178.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 43.62 20.86 0.15 Allowed Glycine 0 N--CA 1.444 -0.791 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.768 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.467 ' O ' ' O ' ' A' ' 74' ' ' PHE . . . 81.55 27.94 45.42 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.055 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.635 ' CD2' ' O ' ' A' ' 71' ' ' MET . 38.5 m-85 -50.45 -174.51 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.69 0.281 . . . . 0.0 110.337 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.8 mttt -167.66 104.76 0.51 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.029 0.442 . . . . 0.0 112.057 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.783 ' CG2' ' CG2' ' A' ' 25' ' ' ILE . 16.8 m -98.13 14.8 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.36 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.392 178.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.851 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.8 OUTLIER 30.77 38.31 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 105.288 -2.115 . . . . 0.0 105.288 -176.869 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.771 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 30.4 t30 -2.52 66.88 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.974 0 CA-C-N 112.776 -2.011 . . . . 0.0 108.858 -174.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.77 ' HD1' ' HB2' ' A' ' 28' ' ' CYS . 36.1 m170 -34.12 120.84 0.45 Allowed 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 113.349 -1.75 . . . . 0.0 112.405 -177.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.48 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.9 p -111.3 -14.25 13.82 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.368 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.786 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -165.08 138.86 4.8 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.1 OUTLIER -120.47 145.88 46.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.072 0.463 . . . . 0.0 111.5 -179.142 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.579 ' CD2' ' O ' ' A' ' 61' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.774 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.573 ' O ' ' N ' ' A' ' 29' ' ' MET . 11.7 t . . . . . 0 CA--C 1.518 -0.259 0 CA-C-O 121.246 0.546 . . . . 0.0 111.041 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.774 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 4.9 mp -64.04 131.28 47.12 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.716 -179.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.669 ' O ' ' O ' ' A' ' 14' ' ' GLU . 2.1 mt-30 -114.35 59.1 0.68 Allowed 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.253 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.669 ' O ' ' O ' ' A' ' 13' ' ' GLN . 31.5 tt0 4.56 125.26 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.327 -1.761 . . . . 0.0 112.231 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.788 ' HB2' HG23 ' A' ' 25' ' ' ILE . 9.1 t-20 -51.8 123.19 24.04 Favored Pre-proline 0 C--N 1.314 -0.937 0 CA-C-N 114.407 -1.269 . . . . 0.0 111.769 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -83.31 20.44 1.17 Allowed 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 122.692 2.261 . . . . 0.0 111.559 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.609 ' CD1' ' HB ' ' A' ' 70' ' ' VAL . 29.9 t80 -133.2 -52.55 0.9 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.449 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.735 ' CD1' ' CG1' ' A' ' 70' ' ' VAL . 0.2 OUTLIER -77.2 -10.78 59.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.964 -179.647 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -61.82 83.64 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.002 0.429 . . . . 0.0 110.682 -179.789 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.614 ' HB3' ' HD2' ' A' ' 21' ' ' PRO . 1.1 mt-30 -110.83 164.76 14.1 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.696 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.614 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 27.3 Cg_endo -61.62 61.33 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.574 2.183 . . . . 0.0 111.544 179.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 157.41 -15.31 0.32 Allowed Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.469 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.539 ' O ' ' O ' ' A' ' 18' ' ' PHE . . . -148.71 104.86 3.44 Favored Pre-proline 0 CA--C 1.514 -0.415 0 CA-C-O 121.905 0.86 . . . . 0.0 111.654 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.652 ' O ' ' O ' ' A' ' 25' ' ' ILE . 92.3 Cg_endo -105.37 67.39 0.02 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.455 0 C-N-CA 124.756 3.637 . . . . 0.0 113.379 -178.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.84 ' CG2' ' H ' ' A' ' 26' ' ' LEU . 29.8 mm -41.87 -173.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.032 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.753 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.84 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -151.51 -157.72 0.84 Allowed 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -175.192 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.529 ' O ' ' CG ' ' A' ' 27' ' ' GLN . 3.8 tt0 169.44 66.12 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 112.895 -1.957 . . . . 0.0 111.321 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.694 ' CB ' ' HD1' ' A' ' 79' ' ' HIS . 17.0 t -23.78 99.35 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.7 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.573 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.061 -179.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.572 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.877 0.37 . . . . 0.0 111.358 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.651 ' HB3' ' CG ' ' A' ' 79' ' ' HIS . . . 11.67 116.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.345 -0.843 . . . . 0.0 113.096 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.682 ' N ' ' O ' ' A' ' 81' ' ' ALA . 6.0 ttmm -54.53 -38.56 66.7 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 177.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.516 ' N ' ' HB3' ' A' ' 81' ' ' ALA . 2.9 m -134.38 166.38 22.97 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.364 -1.289 . . . . 0.0 108.815 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.756 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 0.5 OUTLIER -151.4 159.28 44.32 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.165 -0.614 . . . . 0.0 112.491 -179.285 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.955 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -128.65 28.07 5.44 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 122.554 1.169 . . . . 0.0 107.903 176.798 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.649 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.5 OUTLIER -4.95 130.67 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 112.174 -2.285 . . . . 0.0 113.09 -179.496 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.998 ' O ' HG21 ' A' ' 68' ' ' VAL . 1.6 m -144.57 46.79 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.243 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.69 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 16.9 m -12.05 122.33 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.75 -1.113 . . . . 0.0 111.649 -179.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.735 ' CG1' ' CD1' ' A' ' 18' ' ' PHE . 3.7 m -119.03 -169.1 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.946 0.879 . . . . 0.0 112.759 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.62 ' SD ' ' CZ ' ' A' ' 74' ' ' PHE . 0.4 OUTLIER 21.34 -120.57 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.02 -1.445 . . . . 0.0 112.529 179.917 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.433 ' H ' ' CG ' ' A' ' 71' ' ' MET . . . -70.75 31.66 0.49 Allowed Glycine 0 CA--C 1.518 0.231 0 CA-C-N 115.986 -0.552 . . . . 0.0 113.504 -178.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.541 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 90.85 22.1 34.34 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.685 -0.769 . . . . 0.0 111.756 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.69 ' O ' ' HA ' ' A' ' 69' ' ' THR . 0.6 OUTLIER -45.7 -178.95 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.091 0.472 . . . . 0.0 111.374 -179.887 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.56 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -154.66 82.33 1.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.369 179.543 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.817 ' CG2' ' CG2' ' A' ' 25' ' ' ILE . 27.2 m -78.38 12.25 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.493 -1.241 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.229 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.756 ' O ' ' CB ' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 24.07 44.58 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 -178.364 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.955 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 31.3 t-20 6.36 63.36 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 -174.367 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.774 ' O ' ' CD2' ' A' ' 12' ' ' LEU . 32.2 m170 -37.98 108.79 0.09 Allowed 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.433 -176.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.552 ' CG2' ' O ' ' A' ' 78' ' ' ASN . 4.7 p -104.48 -5.14 21.89 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.012 -1.449 . . . . 0.0 110.702 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.682 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -162.06 144.32 11.33 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 179.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.591 ' SG ' ' CD1' ' A' ' 12' ' ' LEU . 84.5 m -121.13 157.56 29.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.062 0.458 . . . . 0.0 111.718 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.589 ' CD2' ' HA ' ' A' ' 63' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.377 179.628 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.846 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.512 -0.497 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.846 ' N ' ' OG1' ' A' ' 11' ' ' THR . 0.1 OUTLIER -111.5 129.53 56.02 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.156 179.226 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.611 ' O ' ' C ' ' A' ' 14' ' ' GLU . 1.2 mt-30 -103.01 48.15 0.86 Allowed 'General case' 0 CA--C 1.502 -0.899 0 CA-C-O 121.713 0.768 . . . . 0.0 110.846 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.611 ' C ' ' O ' ' A' ' 13' ' ' GLN . 39.4 tt0 -7.12 120.69 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.52 -1.673 . . . . 0.0 110.619 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.752 ' HB2' HG23 ' A' ' 25' ' ' ILE . 0.4 OUTLIER -54.46 98.95 0.19 Allowed Pre-proline 0 C--N 1.306 -1.318 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.98 -178.904 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.593 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 2.8 Cg_exo -73.84 6.0 3.12 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.464 2.109 . . . . 0.0 109.224 177.809 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.523 ' H ' ' C ' ' A' ' 15' ' ' ASN . 1.0 OUTLIER -101.27 -54.3 2.81 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 113.671 -1.604 . . . . 0.0 110.398 -179.673 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.747 ' CD2' HG23 ' A' ' 70' ' ' VAL . 0.4 OUTLIER -86.97 -21.77 25.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.879 -179.714 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.677 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 28.2 t -37.9 107.53 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.758 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.407 ' HG3' ' HB2' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -115.0 171.29 4.59 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.945 -179.692 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -65.63 70.29 0.34 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.855 2.37 . . . . 0.0 111.601 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 135.29 -5.79 4.24 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.197 -179.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.407 ' HB2' ' HG3' ' A' ' 20' ' ' GLN . . . -151.37 102.72 2.93 Favored Pre-proline 0 CA--C 1.513 -0.459 0 CA-C-O 122.037 0.922 . . . . 0.0 111.526 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.677 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 88.6 Cg_endo -103.0 80.02 0.03 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.529 0 C-N-CA 124.788 3.659 . . . . 0.0 113.131 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.828 HG21 HG22 ' A' ' 76' ' ' VAL . 15.1 mm -40.8 -177.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.97 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.634 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.792 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.04 -160.82 1.2 Allowed 'General case' 0 CA--C 1.498 -1.057 0 CA-C-O 122.681 1.229 . . . . 0.0 114.237 -175.624 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.513 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 4.7 tt0 159.98 62.21 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 112.348 -2.206 . . . . 0.0 110.324 179.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.725 ' SG ' ' HB3' ' A' ' 79' ' ' HIS . 75.9 m -23.35 118.69 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.275 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.602 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.387 0 CA-C-O 121.003 0.43 . . . . 0.0 111.389 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.515 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.1 OUTLIER . . . . . 0 CA--C 1.522 -0.107 0 CA-C-O 121.154 0.502 . . . . 0.0 111.288 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.608 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 44.15 112.85 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.528 179.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.661 ' HB3' ' CB ' ' A' ' 81' ' ' ALA . 19.5 ttmt -56.12 -36.69 68.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.589 0.709 . . . . 0.0 109.243 178.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.552 ' O ' ' N ' ' A' ' 80' ' ' THR . 18.5 m -147.09 135.17 21.5 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.752 -1.113 . . . . 0.0 108.62 179.249 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.691 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.3 OUTLIER -119.29 155.27 32.11 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.235 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.92 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -128.91 26.71 5.51 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 176.289 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.696 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.5 OUTLIER -4.91 127.62 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 112.58 -2.1 . . . . 0.0 111.769 -179.529 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.843 ' O ' HG21 ' A' ' 70' ' ' VAL . 2.4 m -128.09 42.43 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.837 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.662 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 73.4 m -19.04 118.2 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.598 -179.032 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.843 HG21 ' O ' ' A' ' 68' ' ' VAL . 0.1 OUTLIER -129.87 -167.5 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.732 179.741 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.59 ' HG3' ' CD2' ' A' ' 74' ' ' PHE . 0.2 OUTLIER 37.04 -137.94 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.342 -179.701 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -80.35 30.63 2.44 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.308 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.66 47.09 0.99 Allowed Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.336 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.662 ' O ' ' HA ' ' A' ' 69' ' ' THR . 9.2 m-30 -90.47 113.42 25.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.844 0.354 . . . . 0.0 110.904 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.572 ' HB3' ' OE1' ' A' ' 77' ' ' GLU . 1.9 mmmm -99.44 107.61 19.87 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.129 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.828 HG22 HG21 ' A' ' 25' ' ' ILE . 11.8 m -97.24 15.84 2.98 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.499 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.43 178.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.696 ' HA ' ' HB3' ' A' ' 67' ' ' ARG . 0.0 OUTLIER 25.03 41.97 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.132 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -177.344 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.92 ' HB3' ' CA ' ' A' ' 66' ' ' ASN . 10.9 t-20 9.19 65.58 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.998 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 -175.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.797 ' O ' ' CD2' ' A' ' 12' ' ' LEU . 25.6 m170 -42.27 89.73 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 122.455 1.122 . . . . 0.0 111.977 -175.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.732 HG21 ' OD1' ' A' ' 78' ' ' ASN . 4.2 p -79.88 -1.33 38.68 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 113.712 -1.585 . . . . 0.0 110.408 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.661 ' CB ' ' HB3' ' A' ' 63' ' ' LYS . . . -177.17 147.05 0.53 Allowed 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 2.7 m -116.15 164.94 13.74 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.875 0.369 . . . . 0.0 111.178 -179.279 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.557 ' CD2' ' HA ' ' A' ' 63' ' ' LYS . 1.9 p80 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.941 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.557 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 2.7 t . . . . . 0 CA--C 1.517 -0.301 0 CA-C-O 120.953 0.406 . . . . 0.0 110.611 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.704 ' CD2' ' HB2' ' A' ' 79' ' ' HIS . 6.5 mp -90.12 136.9 32.77 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.042 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.609 ' O ' ' O ' ' A' ' 14' ' ' GLU . 4.9 mt-30 -108.98 55.11 0.64 Allowed 'General case' 0 CA--C 1.503 -0.863 0 CA-C-O 121.739 0.781 . . . . 0.0 110.55 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.609 ' O ' ' O ' ' A' ' 13' ' ' GLN . 26.8 tt0 -1.13 122.12 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 113.419 -1.719 . . . . 0.0 111.203 -179.271 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.803 ' HB2' HG23 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -50.49 98.5 0.18 Allowed Pre-proline 0 C--N 1.304 -1.371 0 CA-C-N 114.154 -1.385 . . . . 0.0 111.904 -179.201 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.541 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 7.0 Cg_exo -71.8 20.45 0.27 Allowed 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 122.373 2.049 . . . . 0.0 109.592 177.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.627 ' H ' ' C ' ' A' ' 15' ' ' ASN . 1.5 t80 -125.1 -55.8 1.57 Allowed 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.157 -178.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.633 ' HD2' HG22 ' A' ' 25' ' ' ILE . 2.0 m-30 -83.12 -6.17 59.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.173 -179.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.645 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 6.1 t -60.45 83.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.769 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.79 ' O ' ' N ' ' A' ' 22' ' ' GLY . 9.0 mm100 -97.66 145.03 29.01 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.802 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -44.12 69.96 0.01 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.736 2.29 . . . . 0.0 111.459 179.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.79 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 153.06 -20.2 0.75 Allowed Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.126 -179.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.475 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -150.44 108.64 3.15 Favored Pre-proline 0 CA--C 1.515 -0.382 0 CA-C-O 121.892 0.853 . . . . 0.0 111.519 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.645 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 62.9 Cg_endo -101.74 73.06 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.35 0 C-N-CA 124.705 3.603 . . . . 0.0 113.22 -178.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.863 HG21 ' H ' ' A' ' 26' ' ' LEU . 6.9 mm -40.63 -176.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 N-CA-C 113.483 0.919 . . . . 0.0 113.483 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.863 ' H ' HG21 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -150.21 -162.48 1.56 Allowed 'General case' 0 CA--C 1.502 -0.888 0 CA-C-O 122.635 1.207 . . . . 0.0 114.175 -175.692 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.531 ' O ' ' C ' ' A' ' 28' ' ' CYS . 10.6 tt0 164.2 77.67 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 112.661 -2.063 . . . . 0.0 110.903 179.493 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.592 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER -19.21 114.65 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.28 -179.568 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.544 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.8 mtp . . . . . 0 C--N 1.33 -0.269 0 CA-C-O 120.799 0.333 . . . . 0.0 111.204 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.561 ' O ' ' C ' ' A' ' 62' ' ' ALA . 6.0 t . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.702 0.286 . . . . 0.0 110.66 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.561 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 7.65 111.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.589 -179.747 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.762 ' N ' ' O ' ' A' ' 81' ' ' ALA . 6.2 tptp -55.2 -39.23 69.39 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.73 0.776 . . . . 0.0 109.377 178.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.512 ' O ' ' N ' ' A' ' 80' ' ' THR . 0.7 OUTLIER -147.41 133.12 18.89 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.353 179.56 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.64 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 1.6 p90 -115.91 169.54 9.16 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 121.879 0.847 . . . . 0.0 112.527 -178.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.764 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -131.45 27.5 4.72 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 113.888 -1.506 . . . . 0.0 107.133 176.104 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.585 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -4.99 92.6 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.15 -2.296 . . . . 0.0 111.319 -179.736 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.77 HG13 HG13 ' A' ' 25' ' ' ILE . 30.1 t -94.14 71.68 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.401 0 CA-C-N 113.213 -1.812 . . . . 0.0 111.089 -179.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.676 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 99.6 m -54.09 117.72 3.46 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.174 0.511 . . . . 0.0 110.441 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.632 HG23 ' CG ' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -128.13 -166.64 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.849 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.683 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 1.5 mmm 35.89 -135.42 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.53 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -82.16 30.33 3.01 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.357 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 106.33 53.9 0.72 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.545 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.683 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 4.0 m-85 -100.42 112.88 25.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.747 0.308 . . . . 0.0 111.047 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.482 ' O ' ' OE2' ' A' ' 77' ' ' GLU . 19.0 mtpt -99.94 108.98 21.35 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.287 0.565 . . . . 0.0 111.433 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.854 HG22 HG21 ' A' ' 25' ' ' ILE . 15.8 m -94.76 18.0 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.486 -1.483 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.667 179.163 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.841 ' O ' ' HD2' ' A' ' 79' ' ' HIS . 0.4 OUTLIER 29.77 39.12 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 -176.099 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.764 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 38.3 t30 -8.02 70.08 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 113.332 -1.758 . . . . 0.0 108.582 -174.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.841 ' HD2' ' O ' ' A' ' 77' ' ' GLU . 42.5 m170 -40.5 118.04 0.89 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 112.958 -1.928 . . . . 0.0 114.246 -176.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.512 ' N ' ' O ' ' A' ' 64' ' ' SER . 2.3 p -103.46 -7.78 20.66 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 113.481 -1.69 . . . . 0.0 109.888 178.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.762 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -174.38 140.46 0.65 Allowed 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.543 179.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.532 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 1.3 m -128.54 121.56 29.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.714 0.292 . . . . 0.0 110.268 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.599 ' CD2' ' O ' ' A' ' 83' ' ' HIS . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 121.088 0.47 . . . . 0.0 111.677 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.752 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 2.9 t . . . . . 0 CA--C 1.518 -0.277 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.654 ' CD2' ' HB2' ' A' ' 79' ' ' HIS . 4.2 mp -100.86 138.87 37.34 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.085 0.469 . . . . 0.0 111.189 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.646 ' CG ' ' HB2' ' A' ' 29' ' ' MET . 2.4 mt-30 -108.92 58.67 0.6 Allowed 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.209 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.624 ' HG3' ' O ' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -4.12 122.28 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 114.03 -1.441 . . . . 0.0 111.469 -179.429 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.795 ' HB2' HG23 ' A' ' 25' ' ' ILE . 5.3 t-20 -54.92 117.93 15.66 Favored Pre-proline 0 C--N 1.311 -1.105 0 CA-C-N 114.689 -1.141 . . . . 0.0 111.939 -179.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -81.16 14.62 2.06 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.682 2.254 . . . . 0.0 111.556 179.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.471 ' CD2' ' SD ' ' A' ' 71' ' ' MET . 22.9 t80 -119.46 -55.74 2.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.146 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.717 ' HB3' ' CG1' ' A' ' 25' ' ' ILE . 0.7 OUTLIER -72.83 -10.67 60.06 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.152 -179.712 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.621 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 11.0 p -58.2 98.31 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.409 -179.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.639 ' O ' ' N ' ' A' ' 22' ' ' GLY . 6.1 mt-30 -121.96 152.76 60.14 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.905 178.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -45.28 75.79 0.01 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.178 0 C-N-CA 122.734 2.29 . . . . 0.0 112.638 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.639 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 127.86 2.76 6.09 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.556 -0.831 . . . . 0.0 113.269 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.432 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -160.19 98.17 1.46 Allowed Pre-proline 0 CA--C 1.514 -0.432 0 CA-C-O 122.084 0.945 . . . . 0.0 111.769 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.621 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 98.6 Cg_endo -107.73 81.7 0.02 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.575 0 C-N-CA 125.235 3.956 . . . . 0.0 113.5 -178.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.854 HG21 HG22 ' A' ' 76' ' ' VAL . 23.0 mm -44.75 -177.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.807 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -147.56 -158.79 0.95 Allowed 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 -175.386 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.506 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 6.9 tm0? 161.85 94.85 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 112.431 -2.168 . . . . 0.0 109.601 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.752 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -36.01 110.71 0.11 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.9 -178.292 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.658 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.1 tpt . . . . . 0 C--N 1.331 -0.221 0 CA-C-O 120.938 0.399 . . . . 0.0 110.068 178.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.562 ' O ' ' C ' ' A' ' 62' ' ' ALA . 30.9 m . . . . . 0 CA--C 1.518 -0.264 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.612 ' HB3' ' CG ' ' A' ' 79' ' ' HIS . . . 18.08 103.89 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.656 -178.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.973 ' N ' ' O ' ' A' ' 81' ' ' ALA . 6.5 tppt? -52.84 -31.82 41.22 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 121.971 0.891 . . . . 0.0 108.858 178.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.598 ' HB3' ' OG1' ' A' ' 80' ' ' THR . 3.7 t -144.21 152.05 40.33 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 113.806 -1.543 . . . . 0.0 108.535 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.656 ' CG ' ' CG ' ' A' ' 77' ' ' GLU . 1.8 p90 -135.69 164.83 26.98 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.575 0.702 . . . . 0.0 112.093 -179.272 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.697 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 6.6 t-20 -134.66 26.36 3.7 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 122.76 1.267 . . . . 0.0 108.42 177.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.687 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -9.95 132.09 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 112.007 -2.36 . . . . 0.0 112.371 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.801 ' O ' HG21 ' A' ' 68' ' ' VAL . 2.2 m -140.02 44.19 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.873 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.663 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 45.5 m -10.3 119.1 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.888 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.538 ' CG1' ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -116.58 -168.68 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.577 0.704 . . . . 0.0 112.082 179.748 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.649 ' HG3' ' CG ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER 27.96 -139.33 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.581 -1.19 . . . . 0.0 110.954 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -69.5 10.21 2.14 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.614 179.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.46 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 129.26 55.58 0.1 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.986 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.663 ' O ' ' HA ' ' A' ' 69' ' ' THR . 2.0 m-85 -95.33 108.57 20.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.988 0.423 . . . . 0.0 111.051 -179.614 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.455 ' HG2' ' OG1' ' A' ' 69' ' ' THR . 5.3 mtpt -96.44 100.26 11.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.369 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.854 HG22 HG21 ' A' ' 25' ' ' ILE . 22.6 m -87.38 11.8 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.339 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.307 179.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.748 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 30.68 39.11 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 -177.094 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.697 ' HB3' ' HB3' ' A' ' 66' ' ' ASN . 52.3 t30 -3.68 67.45 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 112.98 -1.918 . . . . 0.0 109.092 -174.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.748 ' N ' ' O ' ' A' ' 77' ' ' GLU . 42.3 m170 -37.18 119.45 0.68 Allowed 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 112.802 -1.999 . . . . 0.0 114.362 -176.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.598 ' OG1' ' HB3' ' A' ' 64' ' ' SER . 0.7 OUTLIER -108.95 -7.37 15.42 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 113.552 -1.658 . . . . 0.0 109.926 178.136 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.973 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -168.91 122.08 0.81 Allowed 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.98 178.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.456 ' SG ' ' HA ' ' A' ' 62' ' ' ALA . 1.3 m -119.11 120.09 36.12 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.653 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.96 ' CD2' ' HB2' ' A' ' 63' ' ' LYS . 5.5 m170 . . . . . 0 N--CA 1.466 0.325 0 CA-C-O 121.1 0.476 . . . . 0.0 112.237 -178.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.489 ' O ' ' N ' ' A' ' 29' ' ' MET . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.27 0 CA-C-O 120.893 0.378 . . . . 0.0 110.92 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.858 HD22 ' O ' ' A' ' 79' ' ' HIS . 1.4 mp -60.35 124.25 19.76 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.648 ' HG3' ' CB ' ' A' ' 29' ' ' MET . 0.7 OUTLIER -116.67 60.52 0.74 Allowed 'General case' 0 CA--C 1.502 -0.867 0 CA-C-O 122.044 0.925 . . . . 0.0 111.723 -179.257 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.648 ' CD ' ' HB2' ' A' ' 24' ' ' PRO . 33.3 tt0 3.92 120.42 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 112.949 -1.932 . . . . 0.0 111.459 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.714 ' HB2' HG23 ' A' ' 25' ' ' ILE . 0.5 OUTLIER -53.89 100.74 0.23 Allowed Pre-proline 0 C--N 1.307 -1.264 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.562 -179.608 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.612 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 56.8 Cg_endo -69.98 5.4 1.8 Allowed 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 121.702 1.602 . . . . 0.0 109.951 178.054 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.601 ' HB3' ' CD1' ' A' ' 18' ' ' PHE . 0.3 OUTLIER -101.47 -60.64 1.49 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 113.992 -1.458 . . . . 0.0 110.847 -179.779 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.737 ' CE2' HG22 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -82.67 -2.17 53.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.651 -179.576 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.603 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -59.27 83.77 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.598 179.647 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.493 ' O ' ' N ' ' A' ' 22' ' ' GLY . 4.2 mt-30 -92.94 164.88 20.09 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.407 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.16 59.22 0.17 Allowed 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 122.527 2.151 . . . . 0.0 111.174 179.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 154.7 -14.93 0.53 Allowed Glycine 0 N--CA 1.449 -0.461 0 CA-C-N 115.716 -0.674 . . . . 0.0 112.549 -179.379 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.403 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -142.52 105.16 5.45 Favored Pre-proline 0 CA--C 1.513 -0.448 0 CA-C-O 121.916 0.865 . . . . 0.0 111.374 -179.588 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.648 ' HB2' ' CD ' ' A' ' 14' ' ' GLU . 71.9 Cg_endo -104.05 75.93 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.391 0 C-N-CA 124.687 3.592 . . . . 0.0 114.358 -177.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.864 HG22 HG23 ' A' ' 76' ' ' VAL . 15.2 mm -44.17 -175.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 178.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.828 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -148.65 -161.19 1.29 Allowed 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -176.879 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.637 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 20.8 tt0 161.79 82.91 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 112.421 -2.172 . . . . 0.0 110.822 179.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 1.3 m -35.06 101.83 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.774 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.648 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.372 0 CA-C-O 120.889 0.376 . . . . 0.0 111.225 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.587 ' O ' ' C ' ' A' ' 62' ' ' ALA . 7.1 p . . . . . 0 N--CA 1.457 -0.098 0 CA-C-O 120.75 0.309 . . . . 0.0 110.739 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.587 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 9.11 107.31 0.0 OUTLIER 'General case' 0 C--O 1.231 0.103 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.164 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.882 ' N ' ' O ' ' A' ' 81' ' ' ALA . 2.4 ttmm -55.35 -39.3 69.89 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.652 0.739 . . . . 0.0 109.372 178.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.503 ' N ' ' HB3' ' A' ' 81' ' ' ALA . 2.4 m -144.13 135.03 25.23 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.108 179.362 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.822 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.2 OUTLIER -119.45 160.59 22.06 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.128 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.92 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -123.6 27.65 7.29 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-O 122.5 1.143 . . . . 0.0 107.938 177.423 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.539 ' O ' ' O ' ' A' ' 66' ' ' ASN . 1.9 ttm180 -6.33 128.67 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 112.311 -2.222 . . . . 0.0 112.237 -179.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.78 ' O ' HG21 ' A' ' 70' ' ' VAL . 1.5 m -134.64 36.04 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.954 179.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.594 ' C ' ' O ' ' A' ' 68' ' ' VAL . 23.4 m -17.34 120.55 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.471 -179.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.78 HG21 ' O ' ' A' ' 68' ' ' VAL . 0.2 OUTLIER -125.92 -168.01 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-O 121.718 0.771 . . . . 0.0 112.447 -178.457 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.597 ' SD ' ' CZ ' ' A' ' 17' ' ' PHE . 0.5 OUTLIER 43.86 -134.49 0.57 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.411 -1.268 . . . . 0.0 111.062 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.406 ' H ' ' HB3' ' A' ' 71' ' ' MET . . . -84.94 23.02 8.25 Favored Glycine 0 N--CA 1.434 -1.45 0 C-N-CA 120.71 -0.757 . . . . 0.0 111.694 179.473 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 118.03 37.09 0.9 Allowed Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.183 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.569 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 3.3 m-85 -68.64 -177.66 1.0 Allowed 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 1.5 mtmp? -159.53 134.37 7.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.273 0.559 . . . . 0.0 111.972 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.864 HG23 HG22 ' A' ' 25' ' ' ILE . 18.8 m -140.07 15.22 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.492 -1.255 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.476 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.822 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 20.42 46.58 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -178.069 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.92 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 27.4 t-20 1.18 70.78 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 114.262 -1.335 . . . . 0.0 108.215 -174.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.858 ' O ' HD22 ' A' ' 12' ' ' LEU . 33.6 m170 -39.36 111.42 0.18 Allowed 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 122.582 1.182 . . . . 0.0 111.957 -176.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.592 ' CG2' ' HB2' ' A' ' 66' ' ' ASN . 8.9 p -108.16 -9.33 15.58 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.601 -1.636 . . . . 0.0 110.101 -179.375 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.882 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -165.42 128.55 2.19 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 178.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.509 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.1 OUTLIER -117.67 143.39 46.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.668 0.271 . . . . 0.0 110.753 -178.935 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.441 ' NE2' ' HA ' ' A' ' 63' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.332 -0.193 0 CA-C-O 120.867 0.365 . . . . 0.0 111.516 -179.473 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.593 ' O ' ' N ' ' A' ' 29' ' ' MET . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.243 0 CA-C-O 120.847 0.356 . . . . 0.0 111.388 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.857 HD22 ' O ' ' A' ' 79' ' ' HIS . 3.5 mp -51.2 123.07 8.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.243 179.509 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.704 ' O ' ' O ' ' A' ' 14' ' ' GLU . 2.0 mm-40 -123.34 61.45 1.05 Allowed 'General case' 0 CA--C 1.502 -0.895 0 CA-C-O 122.251 1.024 . . . . 0.0 110.933 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.704 ' O ' ' O ' ' A' ' 13' ' ' GLN . 16.6 tt0 8.29 126.92 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 112.484 -2.144 . . . . 0.0 112.313 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.613 ' ND2' ' CG2' ' A' ' 25' ' ' ILE . 1.4 t-20 -49.86 128.96 21.11 Favored Pre-proline 0 C--N 1.311 -1.096 0 CA-C-N 114.232 -1.349 . . . . 0.0 111.253 179.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -86.06 27.87 0.57 Allowed 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.598 2.198 . . . . 0.0 111.517 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.537 ' HB2' ' CE ' ' A' ' 71' ' ' MET . 54.2 t80 -143.29 -52.65 0.36 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.924 -179.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.768 ' CE2' HG21 ' A' ' 68' ' ' VAL . 0.2 OUTLIER -74.86 -15.43 60.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.28 -179.163 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.914 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -55.5 92.54 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.315 -179.547 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.541 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.1 OUTLIER -121.07 166.51 15.66 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-O 120.916 0.388 . . . . 0.0 111.147 179.803 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.476 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 31.2 Cg_exo -59.28 64.46 0.06 OUTLIER 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.992 2.461 . . . . 0.0 112.194 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.541 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 144.94 -9.89 1.81 Allowed Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.35 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.499 ' O ' ' O ' ' A' ' 18' ' ' PHE . . . -153.19 99.13 2.71 Favored Pre-proline 0 CA--C 1.51 -0.583 0 CA-C-O 122.02 0.914 . . . . 0.0 111.798 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.914 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 71.7 Cg_endo -107.64 72.71 0.02 OUTLIER 'Trans proline' 0 N--CA 1.436 -1.878 0 C-N-CA 124.965 3.777 . . . . 0.0 113.251 -178.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.843 HG21 HG22 ' A' ' 76' ' ' VAL . 22.7 mm -40.09 -176.89 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.043 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.158 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.839 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -148.58 -159.58 1.05 Allowed 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 122.484 1.135 . . . . 0.0 113.826 -176.356 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.524 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 1.2 tp-100 160.01 75.29 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 112.921 -1.945 . . . . 0.0 110.802 179.646 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.568 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 2.3 m -22.74 111.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.618 -179.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.593 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.8 OUTLIER . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.638 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.643 ' O ' ' O ' ' A' ' 62' ' ' ALA . 4.3 p . . . . . 0 CA--C 1.511 -0.528 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.643 ' O ' ' O ' ' A' ' 61' ' ' VAL . . . 37.29 113.78 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.527 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.74 ' N ' ' O ' ' A' ' 81' ' ' ALA . 4.3 ttmm -52.33 -39.66 60.93 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.674 0.75 . . . . 0.0 109.014 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.514 ' O ' ' N ' ' A' ' 80' ' ' THR . 4.4 m -141.13 139.78 34.01 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.971 178.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.649 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 7.2 p90 -123.51 159.38 29.24 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.181 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.92 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -126.71 26.07 6.3 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 122.825 1.298 . . . . 0.0 107.826 176.87 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.579 ' HA ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -3.0 129.75 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 111.912 -2.404 . . . . 0.0 113.766 -179.273 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.768 HG21 ' CE2' ' A' ' 18' ' ' PHE . 1.9 m -149.26 87.7 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.962 178.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.643 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 98.7 m -57.5 127.0 29.82 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.6 0.714 . . . . 0.0 111.955 -178.04 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.682 ' CG1' ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -126.27 -170.23 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 114.684 -1.144 . . . . 0.0 111.124 179.383 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.537 ' CE ' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER 30.55 -136.55 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.058 179.592 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -73.23 21.57 1.06 Allowed Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.695 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.638 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 115.54 33.75 1.54 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.555 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.643 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.2 m-85 -69.0 110.46 4.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.106 0.479 . . . . 0.0 111.233 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.423 ' C ' ' H ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -95.81 89.63 5.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.807 179.82 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.843 HG22 HG21 ' A' ' 25' ' ' ILE . 25.5 m -78.76 13.89 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.495 -1.155 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.904 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.7 ' O ' ' C ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER 23.76 44.74 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 105.685 -1.969 . . . . 0.0 105.685 -177.698 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.92 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 26.6 t-20 1.48 71.96 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.096 0 CA-C-N 114.196 -1.365 . . . . 0.0 108.371 -174.22 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.857 ' O ' HD22 ' A' ' 12' ' ' LEU . 36.4 m170 -41.85 111.6 0.25 Allowed 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 122.644 1.211 . . . . 0.0 111.93 -176.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.538 ' CG2' ' HB2' ' A' ' 66' ' ' ASN . 7.6 p -104.53 -3.32 24.05 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 113.6 -1.637 . . . . 0.0 109.628 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.74 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -171.96 138.6 1.05 Allowed 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.2 OUTLIER -120.86 157.24 30.23 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.729 -0.389 . . . . 0.0 111.325 -179.031 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.463 ' CD2' ' O ' ' A' ' 83' ' ' HIS . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.343 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.903 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.517 -0.313 0 CA-C-O 120.634 0.254 . . . . 0.0 110.326 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.903 ' N ' ' OG1' ' A' ' 11' ' ' THR . 0.5 OUTLIER -114.38 129.71 56.66 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.668 179.83 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.655 ' HG3' ' CB ' ' A' ' 29' ' ' MET . 1.8 mm-40 -97.84 44.83 1.03 Allowed 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 121.7 0.762 . . . . 0.0 110.81 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.735 ' HG2' ' HB2' ' A' ' 24' ' ' PRO . 5.9 tt0 -5.22 122.8 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 113.617 -1.629 . . . . 0.0 110.945 -179.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.789 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.6 OUTLIER -69.38 105.07 0.91 Allowed Pre-proline 0 C--N 1.309 -1.156 0 CA-C-N 114.691 -1.14 . . . . 0.0 113.095 -178.343 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.535 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 3.7 Cg_exo -78.33 3.81 6.82 Favored 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 122.819 2.346 . . . . 0.0 109.472 177.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.483 ' HB3' ' OD1' ' A' ' 15' ' ' ASN . 1.3 t80 -94.61 -63.35 1.19 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 113.874 -1.512 . . . . 0.0 110.08 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.708 ' CD1' ' CG2' ' A' ' 70' ' ' VAL . 8.4 m-85 -79.7 -0.39 33.89 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.362 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.694 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -53.94 104.18 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.942 -179.793 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.602 ' N ' ' O ' ' A' ' 23' ' ' ALA . 0.3 OUTLIER -106.43 177.17 1.41 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.833 179.85 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.489 ' HD2' ' HB2' ' A' ' 20' ' ' GLN . 35.1 Cg_exo -59.55 68.23 0.06 OUTLIER 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.676 2.251 . . . . 0.0 112.018 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.511 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 124.65 19.51 2.51 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.395 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.675 ' O ' ' HA ' ' A' ' 19' ' ' SER . . . -167.0 100.77 0.64 Allowed Pre-proline 0 CA--C 1.509 -0.61 0 CA-C-O 121.952 0.882 . . . . 0.0 110.971 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.793 ' O ' ' O ' ' A' ' 25' ' ' ILE . 28.1 Cg_endo -94.35 23.85 0.42 Allowed 'Trans proline' 0 N--CA 1.452 -0.968 0 C-N-CA 124.525 3.484 . . . . 0.0 113.049 -178.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.852 ' CG2' ' H ' ' A' ' 26' ' ' LEU . 9.8 mm 25.38 -174.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 114.684 -1.144 . . . . 0.0 113.046 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.852 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -159.75 -160.61 0.83 Allowed 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -174.723 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.58 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 2.6 tp60 161.27 59.5 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 112.176 -2.284 . . . . 0.0 110.477 179.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.655 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 73.6 m -15.87 121.29 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.266 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.655 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.757 179.063 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.586 ' O ' ' CG1' ' A' ' 61' ' ' VAL . 25.3 t . . . . . 0 C--O 1.23 0.071 0 CA-C-O 121.15 0.5 . . . . 0.0 110.354 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.693 ' HA ' ' O ' ' A' ' 81' ' ' ALA . . . 26.18 92.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.431 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.86 ' N ' ' O ' ' A' ' 81' ' ' ALA . 8.6 tptp -47.04 -33.84 5.19 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 177.496 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.575 ' HB2' ' OG1' ' A' ' 80' ' ' THR . 0.0 OUTLIER -139.34 -175.61 4.24 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 113.833 -1.531 . . . . 0.0 108.646 178.982 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.855 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -158.88 162.98 37.0 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.554 0.692 . . . . 0.0 112.246 -179.466 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.781 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.2 OUTLIER -133.84 27.53 3.94 Favored 'General case' 0 CA--C 1.504 -0.817 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 176.777 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.641 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -8.66 129.9 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 112.205 -2.27 . . . . 0.0 111.935 -179.607 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.674 HG22 HG13 ' A' ' 25' ' ' ILE . 4.3 m -134.04 46.85 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.759 179.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.565 ' C ' ' O ' ' A' ' 68' ' ' VAL . 41.1 m -20.09 118.56 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.993 -178.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.708 ' CG2' ' CD1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -123.41 -170.0 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.109 -179.048 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.626 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 80.7 mtp 38.99 -134.23 0.14 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.635 179.57 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -75.87 12.33 8.99 Favored Glycine 0 N--CA 1.441 -0.992 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.976 -179.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 122.1 37.67 0.64 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.236 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.626 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 7.1 m-85 -67.14 -176.27 0.53 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.94 92.85 0.87 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.722 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.768 HG22 HG21 ' A' ' 25' ' ' ILE . 29.8 m -86.24 10.6 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.342 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.855 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.5 OUTLIER 30.53 39.38 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 -176.986 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.781 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 48.7 t30 1.75 64.69 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 113.081 -1.872 . . . . 0.0 108.26 -174.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.747 ' N ' HD11 ' A' ' 26' ' ' LEU . 32.8 m170 -31.73 121.49 0.27 Allowed 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 112.764 -2.017 . . . . 0.0 113.28 -176.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.575 ' OG1' ' HB2' ' A' ' 64' ' ' SER . 6.9 p -111.08 -13.64 14.02 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 113.999 -1.455 . . . . 0.0 110.568 -179.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.86 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -164.18 135.26 4.42 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.458 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.532 ' SG ' ' CD1' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -114.03 127.1 55.79 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.474 -0.49 . . . . 0.0 112.23 -178.765 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.494 ' O ' ' CG ' ' A' ' 83' ' ' HIS . 1.7 p80 . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.934 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.629 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 0.3 OUTLIER . . . . . 0 CA--C 1.508 -0.648 0 CA-C-O 121.339 0.59 . . . . 0.0 111.973 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.788 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER -67.59 113.33 5.32 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.997 -1.002 . . . . 0.0 109.602 178.205 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.595 ' O ' ' C ' ' A' ' 14' ' ' GLU . 1.3 mm-40 -101.77 52.75 0.82 Allowed 'General case' 0 CA--C 1.499 -0.997 0 CA-C-O 122.119 0.962 . . . . 0.0 110.527 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.595 ' C ' ' O ' ' A' ' 13' ' ' GLN . 4.7 tt0 -4.47 118.0 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 112.761 -2.018 . . . . 0.0 110.845 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.686 ' ND2' HG13 ' A' ' 76' ' ' VAL . 0.4 OUTLIER -54.63 102.54 0.31 Allowed Pre-proline 0 C--N 1.302 -1.489 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.382 -178.787 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.472 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 1.4 Cg_endo -76.65 1.33 8.62 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.223 1.949 . . . . 0.0 109.046 177.349 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.622 ' CE1' ' HE3' ' A' ' 71' ' ' MET . 1.1 t80 -93.51 -53.64 3.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 113.518 -1.674 . . . . 0.0 110.08 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.736 ' CD2' HG23 ' A' ' 70' ' ' VAL . 4.0 m-85 -87.5 -4.98 58.99 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.63 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.619 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.7 OUTLIER -48.46 97.36 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.346 179.402 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.62 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -101.23 158.28 32.09 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.667 -179.511 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.425 ' CD ' ' HG3' ' A' ' 20' ' ' GLN . 32.5 Cg_exo -57.98 65.76 0.05 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.582 2.188 . . . . 0.0 111.044 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.62 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 134.66 1.06 3.49 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.168 -179.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -150.82 99.99 3.1 Favored Pre-proline 0 CA--C 1.512 -0.519 0 CA-C-O 122.022 0.915 . . . . 0.0 111.424 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.64 ' O ' ' O ' ' A' ' 25' ' ' ILE . 93.2 Cg_endo -103.23 78.87 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.414 0 C-N-CA 124.809 3.673 . . . . 0.0 113.318 -178.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.838 ' CG2' ' H ' ' A' ' 26' ' ' LEU . 15.3 mm -40.45 -177.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.838 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -150.75 -162.76 1.62 Allowed 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 122.413 1.102 . . . . 0.0 113.662 -175.856 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.531 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 7.5 tp-100 166.92 59.76 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 112.918 -1.947 . . . . 0.0 111.104 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.629 ' HA ' ' O ' ' A' ' 11' ' ' THR . 7.4 t -28.2 99.71 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.975 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.571 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 8.2 tpt . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.206 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.606 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.043 0 CA-C-O 120.788 0.328 . . . . 0.0 110.349 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.606 ' O ' ' O ' ' A' ' 61' ' ' VAL . . . 21.12 111.56 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.435 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.639 ' N ' ' O ' ' A' ' 81' ' ' ALA . 2.5 ttmt -52.04 -36.76 51.33 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 178.223 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.517 ' N ' ' HB2' ' A' ' 81' ' ' ALA . 3.5 m -136.09 178.02 7.38 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.273 -1.331 . . . . 0.0 108.863 179.116 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.707 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 2.7 p90 -158.27 157.09 31.85 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.085 -0.646 . . . . 0.0 112.572 -179.639 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.891 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 0.4 OUTLIER -127.42 24.99 6.17 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-O 122.705 1.24 . . . . 0.0 107.989 176.501 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.665 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 3.3 ptt85 -2.87 120.05 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 112.144 -2.298 . . . . 0.0 112.198 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.748 HG23 ' CD1' ' A' ' 25' ' ' ILE . 2.5 m -124.42 45.23 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.504 179.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.61 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 94.5 m -20.12 119.55 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 121.17 0.509 . . . . 0.0 110.747 -178.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.736 HG23 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -122.88 -164.02 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.005 -179.169 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.622 ' HE3' ' CE1' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -28.3 138.72 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.45 -1.25 . . . . 0.0 111.323 -179.583 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 57.04 11.94 6.68 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.005 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.53 ' N ' ' O ' ' A' ' 70' ' ' VAL . . . 74.96 39.29 38.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.141 -179.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.61 ' O ' ' HA ' ' A' ' 69' ' ' THR . 12.9 m-85 -73.48 114.51 11.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.95 0.405 . . . . 0.0 111.219 -179.616 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.417 ' C ' ' H ' ' A' ' 77' ' ' GLU . 4.7 mtmm -95.57 95.81 8.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.734 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.769 ' CG2' ' CG2' ' A' ' 25' ' ' ILE . 26.8 m -83.59 10.7 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.35 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.707 ' O ' ' CB ' ' A' ' 65' ' ' TYR . 0.3 OUTLIER 28.15 40.44 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 -177.145 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.891 ' HB3' ' CA ' ' A' ' 66' ' ' ASN . 9.9 t-20 8.96 63.17 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.991 0 CA-C-N 113.932 -1.485 . . . . 0.0 107.42 -175.627 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.788 ' O ' ' CD2' ' A' ' 12' ' ' LEU . 28.5 m170 -37.76 99.8 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.233 0 CA-C-O 122.498 1.142 . . . . 0.0 111.781 -175.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.696 HG21 ' OD1' ' A' ' 78' ' ' ASN . 10.2 p -95.9 0.25 51.76 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 113.781 -1.554 . . . . 0.0 111.347 -178.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.639 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -167.8 146.81 4.78 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.038 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 84.2 m -120.4 170.19 9.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.827 0.346 . . . . 0.0 111.428 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.936 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.778 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.223 -0.293 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.809 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 8.5 mp -145.74 127.04 14.86 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.865 0.364 . . . . 0.0 111.348 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.585 ' O ' ' C ' ' A' ' 14' ' ' GLU . 2.9 mm-40 -92.81 46.6 1.24 Allowed 'General case' 0 CA--C 1.504 -0.813 0 CA-C-O 121.799 0.809 . . . . 0.0 110.397 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.602 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 4.1 tt0 -0.59 117.63 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 113.522 -1.672 . . . . 0.0 111.419 -178.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.756 ' HB2' HG23 ' A' ' 25' ' ' ILE . 1.2 t-20 -58.76 103.93 0.39 Allowed Pre-proline 0 C--N 1.306 -1.288 0 CA-C-N 113.957 -1.474 . . . . 0.0 111.214 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.453 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 3.0 Cg_exo -74.27 14.85 0.68 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.914 2.409 . . . . 0.0 112.167 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.437 ' H ' ' C ' ' A' ' 15' ' ' ASN . 58.9 t80 -113.42 -50.84 2.84 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.415 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.849 ' HB3' ' CG1' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -79.82 -11.17 59.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.237 -179.549 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.609 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -52.36 104.36 0.09 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.63 -179.391 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.596 ' CG ' ' O ' ' A' ' 18' ' ' PHE . 0.9 OUTLIER -123.14 166.13 19.4 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.581 179.402 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.05 76.99 0.02 OUTLIER 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.703 2.269 . . . . 0.0 112.501 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 119.81 10.23 7.8 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.516 -0.849 . . . . 0.0 112.982 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -161.38 98.1 1.28 Allowed Pre-proline 0 CA--C 1.512 -0.504 0 CA-C-O 122.141 0.972 . . . . 0.0 112.227 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.609 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 74.2 Cg_endo -106.55 82.45 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.549 1 C-N-CA 125.301 4.001 . . . . 0.0 111.958 -179.356 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.849 ' CG1' ' HB3' ' A' ' 18' ' ' PHE . 32.8 mm -42.01 -176.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.817 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -155.92 -156.97 0.68 Allowed 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 115.028 1.492 . . . . 0.0 115.028 -173.579 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.525 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 1.3 tp-100 160.78 72.19 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 112.637 -2.074 . . . . 0.0 110.575 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.811 ' SG ' ' HB3' ' A' ' 79' ' ' HIS . 73.8 m -21.39 114.15 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.86 -179.078 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.535 ' CE ' ' OE1' ' A' ' 13' ' ' GLN . 7.1 tpp . . . . . 0 C--N 1.327 -0.402 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.56 ' O ' ' CG1' ' A' ' 61' ' ' VAL . 40.5 t . . . . . 0 C--O 1.231 0.085 0 CA-C-O 121.059 0.457 . . . . 0.0 110.675 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.545 ' HA ' ' HA ' ' A' ' 82' ' ' CYS . . . 32.33 105.59 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.515 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.777 ' N ' ' O ' ' A' ' 81' ' ' ALA . 23.1 tptt -54.49 -42.14 70.4 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.704 0.764 . . . . 0.0 108.946 177.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.579 ' O ' ' N ' ' A' ' 80' ' ' THR . 50.0 m -141.94 123.28 14.82 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.577 179.212 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.735 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 0.4 OUTLIER -114.14 158.86 20.73 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.639 0.733 . . . . 0.0 112.93 -177.81 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.922 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -128.55 30.35 5.16 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 176.466 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.658 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -7.6 133.49 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 112.17 -2.286 . . . . 0.0 112.401 -179.35 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.753 HG22 HG13 ' A' ' 25' ' ' ILE . 2.4 m -139.47 45.17 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.87 -179.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.654 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 21.8 m -10.75 119.18 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.649 -179.368 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.753 ' CG1' ' CD1' ' A' ' 18' ' ' PHE . 4.6 m -120.61 -169.81 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.787 0.804 . . . . 0.0 112.635 -178.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.596 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 11.1 mtt 37.12 -125.44 0.19 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.304 -1.317 . . . . 0.0 111.087 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -87.74 36.51 3.35 Favored Glycine 0 N--CA 1.437 -1.29 0 CA-C-N 115.399 -0.819 . . . . 0.0 112.682 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.521 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 104.33 21.27 9.5 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.118 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.654 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.8 m-85 -52.15 -177.84 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.607 0.241 . . . . 0.0 111.01 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.568 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -154.34 106.39 2.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 179.753 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.817 ' CG2' ' CG2' ' A' ' 25' ' ' ILE . 22.8 m -104.95 12.49 8.14 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.368 0 CA-C-O 121.043 0.449 . . . . 0.0 110.477 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.735 ' O ' ' CB ' ' A' ' 65' ' ' TYR . 0.4 OUTLIER 23.7 43.88 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 -178.282 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.922 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 15.6 t-20 8.2 64.74 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.967 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 -175.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.811 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 26.5 m170 -41.36 90.61 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 122.362 1.077 . . . . 0.0 112.437 -175.412 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.595 HG21 ' OD1' ' A' ' 78' ' ' ASN . 4.2 p -83.29 -4.32 58.32 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 113.946 -1.479 . . . . 0.0 110.146 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.777 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -176.23 141.04 0.42 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.616 ' SG ' ' O ' ' A' ' 11' ' ' THR . 1.5 m -114.87 151.68 33.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.825 0.345 . . . . 0.0 110.95 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.615 ' CD2' ' O ' ' A' ' 83' ' ' HIS . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.247 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.936 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.655 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 0.2 OUTLIER . . . . . 0 CA--C 1.508 -0.66 0 CA-C-O 121.457 0.646 . . . . 0.0 111.886 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.781 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER -67.82 120.31 13.93 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.139 178.553 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.647 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.1 mt-30 -111.0 56.48 0.63 Allowed 'General case' 0 CA--C 1.501 -0.929 0 CA-C-O 122.015 0.912 . . . . 0.0 110.814 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.647 ' O ' ' O ' ' A' ' 13' ' ' GLN . 23.8 tt0 2.91 121.49 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 112.703 -2.044 . . . . 0.0 111.194 -179.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.866 ' ND2' HG13 ' A' ' 76' ' ' VAL . 0.4 OUTLIER -48.91 99.23 0.21 Allowed Pre-proline 0 C--N 1.306 -1.318 0 CA-C-N 114.455 -1.248 . . . . 0.0 111.697 -179.289 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.588 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 40.4 Cg_endo -66.51 5.0 0.81 Allowed 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 121.88 1.72 . . . . 0.0 109.765 178.031 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.612 ' CZ ' ' SD ' ' A' ' 71' ' ' MET . 0.6 OUTLIER -103.65 -56.93 2.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 113.883 -1.508 . . . . 0.0 110.514 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.793 ' CD2' HG22 ' A' ' 70' ' ' VAL . 0.6 OUTLIER -87.63 -2.33 58.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.007 -179.666 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.723 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.3 m -60.0 86.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.645 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.631 ' O ' ' N ' ' A' ' 22' ' ' GLY . 3.4 pt20 -108.67 154.37 41.72 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.788 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -57.14 66.74 0.04 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.23 0 C-N-CA 122.563 2.175 . . . . 0.0 111.232 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.631 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 149.56 -15.36 1.09 Allowed Glycine 0 N--CA 1.449 -0.438 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.681 -179.031 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.445 ' O ' ' O ' ' A' ' 18' ' ' PHE . . . -148.21 99.39 3.68 Favored Pre-proline 0 CA--C 1.51 -0.576 0 CA-C-O 122.007 0.908 . . . . 0.0 110.822 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.723 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 62.5 Cg_endo -104.57 66.36 0.02 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.692 0 C-N-CA 124.718 3.612 . . . . 0.0 113.755 -178.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.804 HG21 HG22 ' A' ' 76' ' ' VAL . 15.4 mm -39.75 -179.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 N-CA-C 112.789 0.662 . . . . 0.0 112.789 179.174 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.795 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -148.52 -163.01 1.68 Allowed 'General case' 0 CA--C 1.497 -1.078 0 CA-C-O 122.624 1.202 . . . . 0.0 113.992 -176.073 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.572 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 8.6 tp60 167.77 62.66 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 112.501 -2.136 . . . . 0.0 111.005 179.439 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.655 ' HA ' ' O ' ' A' ' 11' ' ' THR . 1.2 t -28.74 99.72 0.02 OUTLIER 'General case' 0 C--O 1.23 0.075 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.065 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.538 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 19.0 tpp . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.037 -179.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.549 ' O ' ' O ' ' A' ' 62' ' ' ALA . 11.4 p . . . . . 0 C--O 1.231 0.095 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.549 ' O ' ' O ' ' A' ' 61' ' ' VAL . . . 24.54 106.88 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.456 -179.344 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.804 ' N ' ' O ' ' A' ' 81' ' ' ALA . 9.7 ttmm -55.25 -42.66 73.78 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 177.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.477 ' HB2' ' OG1' ' A' ' 80' ' ' THR . 0.7 OUTLIER -136.9 136.81 38.98 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.251 -1.341 . . . . 0.0 108.901 178.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.692 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 6.2 p90 -126.2 160.94 28.87 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.141 0.496 . . . . 0.0 112.264 -178.045 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.86 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 1.2 t30 -126.08 27.03 6.39 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-O 122.51 1.148 . . . . 0.0 107.945 176.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.576 ' HG3' ' HA ' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -9.57 122.94 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 112.466 -2.152 . . . . 0.0 111.367 -179.46 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.73 ' O ' HG21 ' A' ' 68' ' ' VAL . 2.4 m -119.47 40.81 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.186 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.694 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 48.0 m -18.08 118.39 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.282 -179.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.793 HG22 ' CD2' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -131.76 -167.37 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-O 121.608 0.718 . . . . 0.0 112.215 -178.544 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.612 ' SD ' ' CZ ' ' A' ' 17' ' ' PHE . 0.0 OUTLIER 42.32 -131.57 0.53 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.755 -179.839 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -83.7 36.5 2.82 Favored Glycine 0 N--CA 1.435 -1.394 0 CA-C-N 115.263 -0.881 . . . . 0.0 112.099 179.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 94.55 47.0 2.84 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.034 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.694 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.5 m-85 -78.28 178.53 7.57 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.662 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -155.59 110.18 2.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.984 0.421 . . . . 0.0 111.669 -179.876 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.866 HG13 ' ND2' ' A' ' 15' ' ' ASN . 10.1 m -107.5 10.59 9.12 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.416 0 CA-C-O 121.288 0.566 . . . . 0.0 109.686 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.772 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER 28.54 40.12 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 -177.601 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.86 ' HB3' ' CA ' ' A' ' 66' ' ' ASN . 13.9 t-20 5.95 62.26 0.0 OUTLIER 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 -176.105 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.781 ' O ' ' CD2' ' A' ' 12' ' ' LEU . 28.4 m170 -37.17 103.67 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.252 0 CA-C-O 122.409 1.1 . . . . 0.0 112.026 -175.239 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.649 ' CG2' ' O ' ' A' ' 78' ' ' ASN . 7.8 p -102.44 -5.58 23.92 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 113.777 -1.556 . . . . 0.0 111.32 -178.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.804 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -167.2 135.34 2.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.489 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 15.6 m -115.84 155.14 28.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.832 0.349 . . . . 0.0 111.095 -179.109 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.566 ' CD2' ' O ' ' A' ' 83' ' ' HIS . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.226 0 CA-C-O 120.964 0.411 . . . . 0.0 111.075 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.648 ' O ' ' N ' ' A' ' 29' ' ' MET . 9.2 t . . . . . 0 CA--C 1.512 -0.506 0 CA-C-O 120.821 0.343 . . . . 0.0 110.098 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.699 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 4.6 mp -79.76 136.72 36.82 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.554 -179.532 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.629 ' O ' ' O ' ' A' ' 14' ' ' GLU . 42.9 mt-30 -115.39 60.53 0.7 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.212 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.629 ' O ' ' O ' ' A' ' 13' ' ' GLN . 20.9 tt0 2.8 121.2 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.752 -179.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.7 ' HB2' HG23 ' A' ' 25' ' ' ILE . 1.5 t-20 -51.71 113.07 3.67 Favored Pre-proline 0 C--N 1.306 -1.311 0 CA-C-N 113.866 -1.515 . . . . 0.0 112.139 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_endo -79.86 18.16 1.18 Allowed 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.418 2.079 . . . . 0.0 111.607 178.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.574 ' CD2' ' SD ' ' A' ' 71' ' ' MET . 15.6 t80 -124.88 -55.28 1.61 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.487 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.787 ' CD1' ' CG1' ' A' ' 70' ' ' VAL . 0.2 OUTLIER -73.03 -16.17 61.5 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.829 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.481 ' HB3' ' O ' ' A' ' 15' ' ' ASN . 4.2 p -49.18 88.05 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.627 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.599 ' O ' ' N ' ' A' ' 22' ' ' GLY . 4.3 mt-30 -113.58 160.21 32.57 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.063 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.14 67.21 0.03 OUTLIER 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.757 2.304 . . . . 0.0 112.19 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.599 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 144.54 -5.45 1.58 Allowed Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.811 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.427 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -153.46 105.32 2.56 Favored Pre-proline 0 CA--C 1.515 -0.376 0 CA-C-O 122.006 0.907 . . . . 0.0 111.858 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.672 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.4 Cg_endo -102.95 68.26 0.03 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.457 0 C-N-CA 124.904 3.736 . . . . 0.0 112.528 -179.332 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.855 ' CG2' ' H ' ' A' ' 26' ' ' LEU . 24.4 mm -39.82 -174.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -179.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.855 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -153.63 -159.21 0.95 Allowed 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -174.858 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.497 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 1.9 tt0 160.16 101.61 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 112.661 -2.063 . . . . 0.0 110.062 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.55 ' HB2' ' HD1' ' A' ' 79' ' ' HIS . 0.1 OUTLIER -47.11 103.71 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.115 -179.005 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.648 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.935 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.586 ' O ' ' C ' ' A' ' 62' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.175 0 CA-C-O 120.7 0.286 . . . . 0.0 110.57 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.603 ' HA ' ' O ' ' A' ' 81' ' ' ALA . . . -5.71 102.73 0.01 OUTLIER 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 122.071 0.938 . . . . 0.0 112.317 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.824 ' HG3' ' C ' ' A' ' 81' ' ' ALA . 0.1 OUTLIER -50.8 -44.85 59.05 Favored 'General case' 0 CA--C 1.49 -1.33 0 CA-C-N 113.613 -1.63 . . . . 0.0 108.597 178.028 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.678 ' O ' ' N ' ' A' ' 80' ' ' THR . 37.2 m -138.96 112.48 8.25 Favored 'General case' 0 N--CA 1.425 -1.677 0 CA-C-N 113.625 -1.625 . . . . 0.0 110.395 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.696 ' CG ' ' CG ' ' A' ' 77' ' ' GLU . 0.9 OUTLIER -99.66 164.25 12.14 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.843 -178.823 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.782 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -134.65 29.16 3.56 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 177.317 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.595 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -6.18 129.98 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 112.099 -2.319 . . . . 0.0 112.487 -179.678 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.837 HG22 HG13 ' A' ' 25' ' ' ILE . 3.2 m -141.04 47.31 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.593 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.669 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 20.1 m -6.92 118.64 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.138 -179.075 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.787 ' CG1' ' CD1' ' A' ' 18' ' ' PHE . 5.4 m -119.01 -169.48 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.867 0.841 . . . . 0.0 112.851 -178.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.574 ' SD ' ' CD2' ' A' ' 17' ' ' PHE . 3.0 mmt 34.51 -127.86 0.09 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.212 -1.358 . . . . 0.0 111.517 179.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -83.02 35.81 2.73 Favored Glycine 0 N--CA 1.44 -1.06 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.585 -179.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.479 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 103.33 19.24 12.74 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.869 -0.682 . . . . 0.0 112.027 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.708 ' HB2' ' CG2' ' A' ' 70' ' ' VAL . 3.0 m-85 -52.03 -176.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.656 0.265 . . . . 0.0 111.038 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.566 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 18.9 mtmm -153.36 94.85 1.86 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.902 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.78 ' CG2' ' CG2' ' A' ' 25' ' ' ILE . 31.7 m -86.44 10.77 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.359 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.633 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.727 ' O ' ' HD2' ' A' ' 79' ' ' HIS . 0.1 OUTLIER 26.46 42.01 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 105.666 -1.975 . . . . 0.0 105.666 -177.632 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.782 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 51.6 t30 -0.86 69.98 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.846 0 CA-C-N 113.51 -1.677 . . . . 0.0 109.16 -174.209 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.727 ' HD2' ' O ' ' A' ' 77' ' ' GLU . 41.3 m170 -43.34 111.76 0.31 Allowed 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 113.472 -1.694 . . . . 0.0 113.5 -176.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.678 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.5 p -91.71 -33.58 14.98 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 113.731 -1.577 . . . . 0.0 108.413 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.824 ' C ' ' HG3' ' A' ' 63' ' ' LYS . . . -149.55 150.04 31.64 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 177.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.9 OUTLIER -129.35 130.41 46.04 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.075 0.464 . . . . 0.0 111.674 -179.612 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.611 ' HB3' ' HD2' ' A' ' 63' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.463 0.181 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.615 -179.718 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.768 0.318 . . . . 0.0 111.218 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.749 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 6.0 mp -54.66 130.86 41.92 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.977 178.912 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.671 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.8 mm-40 -127.57 62.31 1.38 Allowed 'General case' 0 CA--C 1.506 -0.727 0 CA-C-O 122.357 1.075 . . . . 0.0 111.734 -179.853 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.678 ' O ' ' HD3' ' A' ' 16' ' ' PRO . 0.9 OUTLIER 6.46 125.87 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 112.241 -2.254 . . . . 0.0 112.295 179.538 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.69 ' HB2' HG23 ' A' ' 25' ' ' ILE . 0.5 OUTLIER -56.15 100.2 0.21 Allowed Pre-proline 0 C--N 1.314 -0.944 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.889 179.782 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.678 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 66.0 Cg_endo -72.86 4.81 3.35 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 121.738 1.625 . . . . 0.0 109.315 177.342 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.542 ' CD2' ' CE1' ' A' ' 18' ' ' PHE . 1.1 t80 -106.02 -57.87 1.99 Allowed 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 113.724 -1.58 . . . . 0.0 110.364 -179.839 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.72 ' CE2' HG22 ' A' ' 70' ' ' VAL . 3.6 m-30 -81.58 0.67 37.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.622 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.49 102.95 0.6 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.012 179.899 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.601 ' HB3' ' HD2' ' A' ' 21' ' ' PRO . 12.9 mt-30 -111.54 162.21 22.02 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.286 179.607 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.601 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 24.9 Cg_endo -60.47 66.37 0.08 OUTLIER 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.647 2.232 . . . . 0.0 111.812 179.773 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.537 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 147.14 -10.96 1.37 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.345 -179.623 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.468 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -146.89 106.38 3.95 Favored Pre-proline 0 CA--C 1.514 -0.441 0 CA-C-O 121.858 0.837 . . . . 0.0 111.349 -179.662 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.546 ' HB2' ' CD ' ' A' ' 14' ' ' GLU . 97.3 Cg_endo -104.03 75.44 0.03 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.573 0 C-N-CA 124.752 3.634 . . . . 0.0 113.083 -178.48 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.878 HG22 HG22 ' A' ' 76' ' ' VAL . 15.5 mm -44.47 -175.35 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.911 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.838 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -146.04 -166.36 2.44 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 -176.026 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.534 ' O ' ' C ' ' A' ' 28' ' ' CYS . 0.0 OUTLIER 164.32 75.17 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 112.501 -2.136 . . . . 0.0 111.993 178.735 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.597 ' SG ' ' CD1' ' A' ' 12' ' ' LEU . 14.1 m -23.53 101.0 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.709 179.211 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.3 ttt . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.894 -179.388 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.583 ' O ' ' C ' ' A' ' 62' ' ' ALA . 2.2 p . . . . . 0 CA--C 1.522 -0.106 0 CA-C-O 120.728 0.299 . . . . 0.0 110.214 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.606 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 10.64 104.29 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.073 -179.224 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 1.046 ' N ' ' O ' ' A' ' 81' ' ' ALA . 70.4 tttt -53.35 -36.29 61.18 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 178.148 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.474 ' N ' ' HB2' ' A' ' 81' ' ' ALA . 8.0 m -139.08 163.01 33.54 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.326 -1.306 . . . . 0.0 108.558 178.867 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.72 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.7 OUTLIER -144.57 159.29 43.04 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.616 -179.236 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.858 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 0.9 OUTLIER -124.28 24.83 7.94 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 122.677 1.227 . . . . 0.0 107.817 176.88 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.558 ' HA ' ' HA ' ' A' ' 77' ' ' GLU . 3.9 ttt180 1.0 121.53 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 111.997 -2.365 . . . . 0.0 112.04 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.746 HG23 ' CD1' ' A' ' 25' ' ' ILE . 1.5 m -128.27 39.81 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.893 179.668 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.652 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 47.8 m -21.45 118.61 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.062 -179.454 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.72 HG22 ' CE2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -121.29 -168.87 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.775 0.797 . . . . 0.0 112.636 -178.767 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.476 ' HB2' ' CD2' ' A' ' 74' ' ' PHE . 61.0 mmm 30.17 -131.45 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.127 -1.397 . . . . 0.0 111.571 -179.918 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -63.04 -0.39 3.03 Favored Glycine 0 N--CA 1.442 -0.923 0 CA-C-N 115.342 -0.845 . . . . 0.0 113.271 -179.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.532 ' N ' ' O ' ' A' ' 70' ' ' VAL . . . 119.62 37.11 0.8 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.156 -179.782 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.652 ' O ' ' HA ' ' A' ' 69' ' ' THR . 32.2 m-85 -64.08 -178.67 0.36 Allowed 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.498 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.624 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -153.87 95.13 1.84 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -179.576 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.878 HG22 HG22 ' A' ' 25' ' ' ILE . 14.1 m -92.15 16.89 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.494 -1.201 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.323 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.72 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 22.38 45.12 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 -177.934 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.858 ' HB3' ' CA ' ' A' ' 66' ' ' ASN . 9.0 t-20 3.16 71.13 0.0 OUTLIER 'General case' 0 CA--C 1.498 -1.041 0 CA-C-N 114.407 -1.269 . . . . 0.0 107.601 -175.226 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.749 ' O ' ' CD2' ' A' ' 12' ' ' LEU . 33.2 m170 -41.99 115.06 0.61 Allowed 'General case' 0 C--N 1.304 -1.383 0 CA-C-O 122.372 1.082 . . . . 0.0 111.475 -176.277 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.657 ' CG2' ' HB2' ' A' ' 66' ' ' ASN . 11.0 p -114.02 -2.83 13.42 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 113.779 -1.555 . . . . 0.0 110.761 -178.578 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 1.046 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -168.35 112.48 0.61 Allowed 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.79 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.5 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.5 OUTLIER -99.87 153.96 18.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.692 0.282 . . . . 0.0 110.838 -179.284 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.4 ' O ' ' CG ' ' A' ' 83' ' ' HIS . 1.6 p80 . . . . . 0 C--N 1.329 -0.292 0 CA-C-O 120.942 0.401 . . . . 0.0 111.092 -179.975 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.831 ' O ' ' N ' ' A' ' 29' ' ' MET . 0.1 OUTLIER . . . . . 0 CA--C 1.508 -0.666 0 CA-C-O 121.158 0.504 . . . . 0.0 110.157 . . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.843 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 0.8 OUTLIER -74.98 135.77 41.33 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.462 -179.224 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.635 ' O ' ' O ' ' A' ' 14' ' ' GLU . 6.8 mt-30 -122.18 54.15 1.19 Allowed 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 121.715 0.769 . . . . 0.0 109.707 177.808 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.635 ' O ' ' O ' ' A' ' 13' ' ' GLN . 5.0 tt0 -2.93 125.66 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 113.495 -1.684 . . . . 0.0 111.445 -178.546 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.766 ' HB2' HG23 ' A' ' 25' ' ' ILE . 0.5 OUTLIER -62.16 106.0 0.74 Allowed Pre-proline 0 C--N 1.309 -1.173 0 CA-C-N 114.335 -1.302 . . . . 0.0 112.274 -179.176 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.429 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 4.3 Cg_exo -77.19 10.88 2.25 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 122.531 2.154 . . . . 0.0 109.415 177.453 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.564 ' CE1' ' SD ' ' A' ' 71' ' ' MET . 0.9 OUTLIER -106.48 -61.15 1.56 Allowed 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.138 -1.392 . . . . 0.0 111.296 -179.196 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.697 ' CG ' HG23 ' A' ' 70' ' ' VAL . 5.2 m-85 -81.72 -3.22 53.14 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.714 -178.718 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.664 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 58.4 p -58.75 89.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.974 0.416 . . . . 0.0 110.723 -179.886 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.589 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -88.57 165.99 25.18 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.933 179.731 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.473 ' HD2' ' HG3' ' A' ' 20' ' ' GLN . 22.6 Cg_endo -61.43 59.02 0.11 Allowed 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 122.348 2.032 . . . . 0.0 111.452 179.638 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.589 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 157.39 -16.53 0.34 Allowed Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 115.773 -0.648 . . . . 0.0 112.622 -179.534 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.48 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -145.22 109.25 4.6 Favored Pre-proline 0 CA--C 1.517 -0.324 0 CA-C-O 121.966 0.889 . . . . 0.0 112.168 -179.316 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.664 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 69.0 Cg_endo -101.81 78.81 0.04 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.284 0 C-N-CA 124.912 3.741 . . . . 0.0 113.401 -179.086 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.856 HG21 ' H ' ' A' ' 26' ' ' LEU . 5.6 mm -39.18 -176.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.856 ' H ' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.98 -160.12 1.09 Allowed 'General case' 0 CA--C 1.503 -0.856 0 CA-C-O 122.509 1.147 . . . . 0.0 113.955 -175.974 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 14.2 tt0 162.75 78.24 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 112.853 -1.976 . . . . 0.0 111.339 179.392 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.791 ' HA ' ' O ' ' A' ' 11' ' ' THR . 77.1 m -25.52 100.24 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.174 179.885 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.831 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.942 179.8 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.57 ' O ' ' C ' ' A' ' 62' ' ' ALA . 56.7 t . . . . . 0 CA--C 1.519 -0.22 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.57 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 10.23 108.36 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.514 -0.766 . . . . 0.0 112.196 -179.621 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.821 ' N ' ' O ' ' A' ' 81' ' ' ALA . 36.5 tttt -51.81 -33.36 35.41 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.582 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.54 ' CB ' ' OG1' ' A' ' 80' ' ' THR . 13.8 m -141.3 165.3 27.89 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.943 179.075 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.656 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 0.3 OUTLIER -147.22 161.83 40.14 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.239 0.542 . . . . 0.0 111.936 -179.356 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.795 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.1 OUTLIER -134.5 29.59 3.57 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-O 122.74 1.257 . . . . 0.0 107.698 176.787 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.616 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -9.76 128.73 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 112.029 -2.35 . . . . 0.0 112.163 -179.458 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.739 HG12 HD13 ' A' ' 25' ' ' ILE . 4.3 m -136.06 48.35 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 114.812 -1.086 . . . . 0.0 110.282 179.883 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.605 ' C ' ' O ' ' A' ' 68' ' ' VAL . 89.1 m -20.08 118.27 0.03 OUTLIER 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.048 -179.304 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.697 HG23 ' CG ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -120.48 -172.05 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-O 121.428 0.632 . . . . 0.0 112.525 -178.039 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.564 ' SD ' ' CE1' ' A' ' 17' ' ' PHE . 29.0 mmm 33.2 -127.64 0.06 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.791 -1.095 . . . . 0.0 111.147 -179.275 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -78.71 9.88 34.38 Favored Glycine 0 N--CA 1.438 -1.218 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.651 -179.817 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.551 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 128.68 24.76 1.08 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.763 179.969 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.578 ' O ' ' HA ' ' A' ' 69' ' ' THR . 5.7 m-30 -69.7 118.49 12.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.796 0.331 . . . . 0.0 110.999 -179.791 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.446 ' HB3' ' CD ' ' A' ' 67' ' ' ARG . 0.4 OUTLIER -105.87 110.64 23.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.071 0.462 . . . . 0.0 111.892 -179.668 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.843 HG22 HG21 ' A' ' 25' ' ' ILE . 17.7 m -95.21 12.05 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.439 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.44 178.958 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.72 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER 29.69 39.34 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 105.47 -2.048 . . . . 0.0 105.47 -176.636 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.795 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 55.3 t30 3.11 64.11 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.682 0 CA-C-N 113.341 -1.754 . . . . 0.0 108.405 -174.562 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.843 ' O ' ' CD2' ' A' ' 12' ' ' LEU . 35.8 m170 -38.0 114.05 0.32 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 113.399 -1.728 . . . . 0.0 112.818 -176.689 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.54 ' OG1' ' CB ' ' A' ' 64' ' ' SER . 3.0 p -98.54 -7.3 28.53 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 114.388 -1.278 . . . . 0.0 110.339 -179.734 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.821 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -169.32 136.8 1.8 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.89 178.741 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.65 ' SG ' ' CD1' ' A' ' 12' ' ' LEU . 6.9 m -119.67 119.37 33.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.653 0.263 . . . . 0.0 110.636 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.584 ' CD2' ' O ' ' A' ' 83' ' ' HIS . 0.5 OUTLIER . . . . . 0 C--N 1.325 -0.483 0 CA-C-O 120.917 0.389 . . . . 0.0 110.156 178.996 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.665 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.235 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 . . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.665 ' N ' ' OG1' ' A' ' 11' ' ' THR . 3.3 mp -116.21 141.23 48.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.002 0.43 . . . . 0.0 111.034 179.825 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.722 ' CG ' ' HA ' ' A' ' 29' ' ' MET . 1.3 mt-30 -98.93 45.75 1.0 Allowed 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 121.292 0.568 . . . . 0.0 110.896 179.778 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.662 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 0.9 OUTLIER -5.92 117.92 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.835 -178.729 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.727 ' HB2' HG23 ' A' ' 25' ' ' ILE . 0.5 OUTLIER -58.26 103.53 0.37 Allowed Pre-proline 0 C--N 1.304 -1.378 0 CA-C-N 114.063 -1.426 . . . . 0.0 112.455 -178.659 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.554 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 86.2 Cg_endo -77.4 4.36 5.99 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 122.119 1.879 . . . . 0.0 109.289 177.4 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.607 ' CE2' ' SD ' ' A' ' 71' ' ' MET . 0.8 OUTLIER -95.08 -64.41 1.07 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 113.659 -1.61 . . . . 0.0 109.742 179.563 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.612 ' CD2' ' CG ' ' A' ' 15' ' ' ASN . 7.8 m-85 -74.82 -4.4 37.55 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.994 179.339 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.574 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -57.69 88.57 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.542 179.856 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.723 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.8 OUTLIER -95.3 155.9 38.3 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.057 179.715 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -48.98 69.04 0.02 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.726 2.284 . . . . 0.0 111.754 179.709 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.723 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 137.25 -0.45 2.87 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.77 -179.572 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.534 ' O ' ' HA ' ' A' ' 19' ' ' SER . . . -153.94 104.39 2.47 Favored Pre-proline 0 CA--C 1.517 -0.311 0 CA-C-O 121.806 0.812 . . . . 0.0 112.178 -179.551 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.616 ' O ' ' O ' ' A' ' 25' ' ' ILE . 63.2 Cg_endo -104.64 76.64 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 125.133 3.889 . . . . 0.0 113.491 -178.725 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.861 ' CG2' ' H ' ' A' ' 26' ' ' LEU . 10.1 mm -40.64 -173.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 179.728 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.861 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -151.51 -162.73 1.59 Allowed 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -176.298 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.641 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 35.7 tp60 168.18 50.97 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 113.099 -1.864 . . . . 0.0 111.967 179.55 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.605 ' O ' ' O ' ' A' ' 27' ' ' GLN . 0.8 OUTLIER 26.55 119.14 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 178.705 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.722 ' HA ' ' CG ' ' A' ' 13' ' ' GLN . 1.9 ttp . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.304 177.921 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.534 ' O ' ' O ' ' A' ' 62' ' ' ALA . 2.2 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.811 0.338 . . . . 0.0 110.83 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.614 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 26.11 106.88 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.749 0 CA-C-O 121.993 0.902 . . . . 0.0 112.471 -179.969 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.881 ' HG3' ' CB ' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -49.46 -47.14 48.57 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 113.724 -1.58 . . . . 0.0 107.708 177.023 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.554 ' CB ' ' OG1' ' A' ' 80' ' ' THR . 2.1 p -128.52 156.19 43.67 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 113.193 -1.822 . . . . 0.0 109.243 179.304 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.657 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -141.31 160.81 39.34 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.59 0.709 . . . . 0.0 112.424 -178.308 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.772 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -127.87 28.32 5.6 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-O 122.703 1.239 . . . . 0.0 107.684 177.378 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.542 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.9 OUTLIER -9.23 126.27 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 112.115 -2.311 . . . . 0.0 112.033 -179.688 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.723 HG23 ' CD1' ' A' ' 25' ' ' ILE . 3.1 m -129.55 43.03 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.212 179.466 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.577 ' C ' ' O ' ' A' ' 68' ' ' VAL . 53.9 m -16.16 118.95 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.136 -179.303 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.596 HG13 ' CD1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -125.75 -169.23 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.856 -179.574 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.607 ' SD ' ' CE2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER 41.91 -135.57 0.3 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.977 -1.011 . . . . 0.0 110.862 -179.704 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -78.94 21.14 4.13 Favored Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.667 179.935 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 114.88 41.09 0.86 Allowed Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.296 -179.982 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.564 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 3.2 m-85 -70.21 -175.73 1.03 Allowed 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 179.894 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.585 ' N ' ' CD ' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -160.15 94.39 1.1 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -179.552 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.778 HG22 HG21 ' A' ' 25' ' ' ILE . 31.4 m -88.98 11.8 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.491 -1.309 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.014 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.758 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 27.14 42.35 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 105.336 -2.098 . . . . 0.0 105.336 -176.81 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.772 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 57.4 t30 -1.69 67.21 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.828 0 CA-C-N 113.302 -1.772 . . . . 0.0 108.597 -174.414 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.758 ' N ' ' O ' ' A' ' 77' ' ' GLU . 37.6 m170 -34.27 122.33 0.49 Allowed 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 112.747 -2.024 . . . . 0.0 114.094 -176.493 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.554 ' OG1' ' CB ' ' A' ' 64' ' ' SER . 6.5 p -107.68 -34.25 7.05 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 113.483 -1.69 . . . . 0.0 109.513 178.362 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.881 ' CB ' ' HG3' ' A' ' 63' ' ' LYS . . . -143.17 143.41 31.78 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.808 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.555 ' CA ' ' HG2' ' A' ' 63' ' ' LYS . 1.2 m -129.6 129.86 44.92 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.943 -179.318 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.778 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 0.3 OUTLIER . . . . . 0 CA--C 1.522 -0.108 0 CA-C-O 121.07 0.462 . . . . 0.0 111.08 179.278 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.683 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 1.2 t . . . . . 0 CA--C 1.518 -0.26 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.766 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 11.1 mp -133.55 129.95 37.77 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.001 0.429 . . . . 0.0 110.919 179.644 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.655 ' O ' ' O ' ' A' ' 14' ' ' GLU . 28.1 mt-30 -106.64 55.51 0.66 Allowed 'General case' 0 CA--C 1.504 -0.824 0 CA-C-O 121.444 0.64 . . . . 0.0 111.717 -179.083 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.655 ' O ' ' O ' ' A' ' 13' ' ' GLN . 26.1 tt0 0.03 122.66 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 113.872 -1.513 . . . . 0.0 111.279 -179.611 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.697 ' OD1' ' CZ ' ' A' ' 17' ' ' PHE . 1.0 OUTLIER -51.44 104.34 0.42 Allowed Pre-proline 0 C--N 1.303 -1.422 0 CA-C-N 113.916 -1.493 . . . . 0.0 112.826 -179.116 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.705 ' HD2' ' CE1' ' A' ' 17' ' ' PHE . 55.3 Cg_endo -69.27 7.7 0.81 Allowed 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.161 1.908 . . . . 0.0 112.121 178.943 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.705 ' CE1' ' HD2' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -112.42 -58.95 2.07 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.22 178.778 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.66 ' HB3' ' HB ' ' A' ' 25' ' ' ILE . 0.4 OUTLIER -71.34 -17.03 62.46 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.556 -178.929 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.562 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -51.13 84.07 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.965 -179.606 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.57 ' O ' ' N ' ' A' ' 22' ' ' GLY . 11.4 mm100 -118.51 159.93 41.91 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.06 -179.855 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.494 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 12.9 Cg_endo -55.3 72.84 0.03 OUTLIER 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.868 2.379 . . . . 0.0 111.515 179.298 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.57 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 142.92 -13.35 2.39 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.961 -0.637 . . . . 0.0 111.903 -179.344 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.48 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -150.55 102.22 3.09 Favored Pre-proline 0 CA--C 1.511 -0.525 0 CA-C-O 122.023 0.916 . . . . 0.0 111.826 -179.79 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.665 ' O ' ' O ' ' A' ' 25' ' ' ILE . 87.3 Cg_endo -104.18 60.47 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.543 0 C-N-CA 124.873 3.715 . . . . 0.0 112.433 -179.112 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.839 HG13 HG22 ' A' ' 68' ' ' VAL . 19.9 mm -38.63 -175.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-N 114.916 -1.038 . . . . 0.0 113.544 -179.839 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.813 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.13 -160.85 1.2 Allowed 'General case' 0 CA--C 1.503 -0.862 0 CA-C-O 122.398 1.094 . . . . 0.0 113.699 -174.99 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.554 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 16.6 tt0 163.63 66.2 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 113.179 -1.828 . . . . 0.0 111.261 179.298 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.704 ' CB ' ' HD1' ' A' ' 79' ' ' HIS . 38.9 t -18.96 115.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.573 179.874 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.501 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 0.6 OUTLIER . . . . . 0 C--N 1.324 -0.503 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.354 179.629 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.65 ' O ' ' O ' ' A' ' 62' ' ' ALA . 31.0 m . . . . . 0 N--CA 1.452 -0.347 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.65 ' O ' ' O ' ' A' ' 61' ' ' VAL . . . 24.06 107.93 0.0 OUTLIER 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.976 -178.621 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.906 ' HB2' ' CD2' ' A' ' 83' ' ' HIS . 1.2 ttmt -51.38 -36.24 42.43 Favored 'General case' 0 CA--C 1.503 -0.855 0 CA-C-O 121.797 0.808 . . . . 0.0 109.452 179.614 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.592 ' HB2' ' OG1' ' A' ' 80' ' ' THR . 2.0 p -143.84 142.16 30.7 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.193 -1.367 . . . . 0.0 109.044 178.864 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.672 ' CG ' ' CG ' ' A' ' 77' ' ' GLU . 1.1 p90 -129.54 165.92 20.72 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.672 0.749 . . . . 0.0 112.601 -178.775 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.774 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -133.96 27.48 3.9 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 114.401 -1.272 . . . . 0.0 107.76 176.688 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.659 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -6.86 121.91 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 112.077 -2.329 . . . . 0.0 112.053 179.911 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.839 HG22 HG13 ' A' ' 25' ' ' ILE . 3.8 m -129.16 44.12 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.055 179.516 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.705 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 36.6 m -18.09 118.0 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.68 -178.799 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.634 ' CG1' ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -110.92 -163.42 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.772 0.796 . . . . 0.0 111.812 179.538 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.619 ' HG3' ' CD2' ' A' ' 74' ' ' PHE . 2.4 ptm -34.14 145.57 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.393 -1.276 . . . . 0.0 111.519 -179.555 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 54.3 10.56 2.01 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.659 -0.782 . . . . 0.0 111.977 -179.532 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.491 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 80.68 33.84 29.62 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.192 -179.854 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.705 ' O ' ' HA ' ' A' ' 69' ' ' THR . 9.6 m-85 -65.44 110.29 2.62 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.988 0.423 . . . . 0.0 111.016 -179.873 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.498 ' CD ' ' OG1' ' A' ' 69' ' ' THR . 9.6 mmmt -94.1 98.48 11.02 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.525 -179.837 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.761 HG22 HG21 ' A' ' 25' ' ' ILE . 30.1 m -87.53 10.98 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.489 -1.381 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.136 179.149 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.783 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER 27.45 41.43 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 -177.396 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.774 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 45.0 t30 -0.67 64.95 0.0 OUTLIER 'General case' 0 CA--C 1.501 -0.916 0 CA-C-N 113.371 -1.741 . . . . 0.0 108.542 -174.48 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.783 ' N ' ' O ' ' A' ' 77' ' ' GLU . 36.9 m170 -37.12 122.05 0.84 Allowed 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 112.75 -2.023 . . . . 0.0 113.746 -176.503 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.592 ' OG1' ' HB2' ' A' ' 64' ' ' SER . 2.6 p -108.29 -8.86 15.59 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 113.504 -1.68 . . . . 0.0 109.622 178.718 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.795 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -173.99 137.52 0.57 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.81 179.001 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.776 ' C ' ' CD2' ' A' ' 83' ' ' HIS . 1.8 t -127.7 131.26 49.79 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.7 0.286 . . . . 0.0 111.164 179.855 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.906 ' CD2' ' HB2' ' A' ' 63' ' ' LYS . 3.9 m-70 . . . . . 0 C--N 1.324 -0.541 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.642 -179.821 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.505 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.456 -0.13 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 . . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.691 ' HG ' ' HB2' ' A' ' 79' ' ' HIS . 1.5 mp -114.94 140.88 48.65 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.714 0.293 . . . . 0.0 110.368 179.633 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.729 ' HG3' ' HA ' ' A' ' 29' ' ' MET . 3.1 mm-40 -101.2 50.08 0.87 Allowed 'General case' 0 CA--C 1.499 -0.991 0 CA-C-O 121.936 0.874 . . . . 0.0 111.204 -179.41 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.653 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 2.2 tt0 -0.25 120.12 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 113.183 -1.826 . . . . 0.0 111.554 -179.4 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.697 ' HB2' HG23 ' A' ' 25' ' ' ILE . 1.1 t-20 -52.55 120.29 17.82 Favored Pre-proline 0 C--N 1.308 -1.204 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.56 -179.815 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -82.34 16.93 1.67 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.479 2.119 . . . . 0.0 112.094 179.592 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.609 ' CE2' ' HG3' ' A' ' 71' ' ' MET . 86.9 t80 -123.73 -54.69 1.74 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.874 -179.921 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.827 ' HB3' ' CG1' ' A' ' 25' ' ' ILE . 0.3 OUTLIER -75.09 -7.47 53.83 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.318 -179.353 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.602 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -60.0 101.58 0.13 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.651 -179.308 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.579 ' CB ' ' HD2' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -115.41 177.45 1.19 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.265 179.334 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.579 ' HD2' ' CB ' ' A' ' 20' ' ' GLN . 59.5 Cg_endo -71.44 60.38 2.64 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.484 2.122 . . . . 0.0 111.748 179.566 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 149.65 -10.06 0.92 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.499 -179.576 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -146.95 99.4 4.0 Favored Pre-proline 0 CA--C 1.509 -0.625 0 CA-C-O 122.15 0.976 . . . . 0.0 112.021 -179.657 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.63 ' O ' ' O ' ' A' ' 25' ' ' ILE . 98.0 Cg_endo -104.8 79.94 0.02 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.707 0 C-N-CA 125.094 3.863 . . . . 0.0 112.687 -179.054 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.86 ' CG2' ' H ' ' A' ' 26' ' ' LEU . 24.3 mm -42.56 -173.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-N 115.509 -0.769 . . . . 0.0 113.019 -179.939 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.86 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.97 -159.18 0.97 Allowed 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 -174.822 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.671 ' O ' ' O ' ' A' ' 28' ' ' CYS . 4.0 tm0? 166.04 56.96 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 112.603 -2.09 . . . . 0.0 111.143 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.671 ' O ' ' O ' ' A' ' 27' ' ' GLN . 0.8 OUTLIER 18.37 119.16 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.918 179.876 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.729 ' HA ' ' HG3' ' A' ' 13' ' ' GLN . 5.8 tmm? . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.899 179.041 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.593 ' O ' ' C ' ' A' ' 62' ' ' ALA . 1.3 p . . . . . 0 CA--C 1.521 -0.156 0 CA-C-O 120.963 0.411 . . . . 0.0 110.298 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.593 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 3.03 103.32 0.01 OUTLIER 'General case' 0 CA--C 1.504 -0.793 0 CA-C-O 121.913 0.863 . . . . 0.0 112.559 -179.294 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.8 ' HG3' ' CB ' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -48.36 -44.19 34.24 Favored 'General case' 0 CA--C 1.49 -1.327 0 CA-C-N 113.845 -1.525 . . . . 0.0 107.134 177.014 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.75 ' HB3' ' OG1' ' A' ' 80' ' ' THR . 14.2 t -125.54 -178.61 4.3 Favored 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 112.849 -1.978 . . . . 0.0 109.407 179.647 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.625 ' CB ' ' CG ' ' A' ' 77' ' ' GLU . 3.0 p90 -162.27 160.51 26.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.281 0.562 . . . . 0.0 111.703 -179.491 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.945 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 43.9 t-20 -133.92 28.93 3.82 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 122.851 1.31 . . . . 0.0 107.696 177.501 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.55 ' O ' ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -6.14 130.3 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 111.616 -2.538 . . . . 0.0 112.551 -179.856 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.81 HG22 HG13 ' A' ' 25' ' ' ILE . 3.5 m -139.78 47.8 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.311 179.696 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.618 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 90.1 m -15.89 118.13 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.285 -179.016 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.772 ' CG1' ' CD1' ' A' ' 18' ' ' PHE . 3.0 m -120.28 -160.46 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.8 0 CA-C-O 121.726 0.774 . . . . 0.0 111.913 -179.867 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.609 ' HG3' ' CE2' ' A' ' 17' ' ' PHE . 29.0 mtp -13.04 131.61 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 113.874 -1.512 . . . . 0.0 112.854 -178.955 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 40.03 24.78 0.06 OUTLIER Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 115.458 -0.792 . . . . 0.0 113.214 179.059 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.53 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 84.91 36.98 10.58 Favored Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.872 179.724 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.696 ' HB2' ' CG2' ' A' ' 70' ' ' VAL . 1.2 m-30 -74.59 122.14 22.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.931 0.395 . . . . 0.0 110.822 179.923 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.18 109.62 22.28 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.784 -179.483 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.793 HG22 HG21 ' A' ' 25' ' ' ILE . 34.8 m -98.87 11.76 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.229 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.53 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.705 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER 25.27 42.32 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 -176.968 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.945 ' HB3' ' HB3' ' A' ' 66' ' ' ASN . 51.6 t30 -1.3 67.75 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 113.185 -1.825 . . . . 0.0 109.083 -174.466 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.705 ' N ' ' O ' ' A' ' 77' ' ' GLU . 39.1 m170 -37.36 121.09 0.82 Allowed 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 112.928 -1.942 . . . . 0.0 113.781 -176.921 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.75 ' OG1' ' HB3' ' A' ' 64' ' ' SER . 2.2 p -104.47 -32.2 9.11 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 113.448 -1.706 . . . . 0.0 109.21 178.203 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.8 ' CB ' ' HG3' ' A' ' 63' ' ' LYS . . . -143.15 136.06 27.83 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 177.795 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 1.2 m -124.25 134.74 53.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.902 0.382 . . . . 0.0 110.852 179.973 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.561 ' HB3' ' HD2' ' A' ' 63' ' ' LYS . 2.0 p80 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.384 -179.468 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.698 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 9.2 t . . . . . 0 CA--C 1.509 -0.618 0 CA-C-O 121.185 0.517 . . . . 0.0 110.821 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.697 ' CD2' ' HB2' ' A' ' 79' ' ' HIS . 2.4 mp -95.41 138.12 33.54 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.668 179.354 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.73 ' O ' ' O ' ' A' ' 14' ' ' GLU . 3.7 pt20 -123.0 69.23 0.99 Allowed 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 122.134 0.969 . . . . 0.0 111.749 178.831 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.73 ' O ' ' O ' ' A' ' 13' ' ' GLN . 28.0 tt0 14.78 123.57 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 112.704 -2.044 . . . . 0.0 112.255 179.998 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.874 ' HB2' HG23 ' A' ' 25' ' ' ILE . 33.2 t-20 -48.05 107.26 0.71 Allowed Pre-proline 0 C--N 1.306 -1.31 0 CA-C-N 113.527 -1.67 . . . . 0.0 112.072 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.744 ' HD2' ' CE1' ' A' ' 17' ' ' PHE . 72.8 Cg_endo -73.81 16.37 0.52 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.407 2.072 . . . . 0.0 112.958 179.7 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.744 ' CE1' ' HD2' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -126.24 -57.54 1.39 Allowed 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 121.787 0.804 . . . . 0.0 110.205 178.832 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.759 ' HB3' ' HB ' ' A' ' 25' ' ' ILE . 2.7 t80 -71.92 -19.19 61.96 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.219 -179.088 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.575 ' HB3' ' O ' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -48.76 87.61 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.546 -179.983 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.522 ' O ' ' N ' ' A' ' 22' ' ' GLY . 10.2 mm-40 -112.3 166.3 11.25 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.941 -179.65 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -61.85 60.83 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.752 2.301 . . . . 0.0 111.329 179.337 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.522 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 155.45 -14.24 0.45 Allowed Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.635 -179.611 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.419 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -142.97 108.87 5.44 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-O 121.784 0.802 . . . . 0.0 111.678 -179.492 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.634 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.8 Cg_endo -103.97 60.39 0.02 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.428 0 C-N-CA 124.613 3.542 . . . . 0.0 113.199 -178.556 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.9 HG13 HG22 ' A' ' 68' ' ' VAL . 31.6 mm -43.48 -174.07 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 CA-C-N 115.327 -0.852 . . . . 0.0 112.566 179.194 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.751 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -145.23 -168.27 2.9 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -175.011 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 172.4 96.01 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 111.482 -2.599 . . . . 0.0 109.99 179.2 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.698 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -40.51 112.49 0.29 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.83 -178.924 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.54 ' HG2' ' NE2' ' A' ' 13' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.227 0 C-N-CA 120.463 -0.495 . . . . 0.0 111.946 -179.874 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.587 ' O ' ' C ' ' A' ' 62' ' ' ALA . 2.6 t . . . . . 0 C--O 1.23 0.065 0 CA-C-O 120.832 0.349 . . . . 0.0 110.377 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.587 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . -6.11 105.75 0.01 OUTLIER 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 122.065 0.936 . . . . 0.0 112.415 -179.916 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.791 ' HG3' ' CB ' ' A' ' 81' ' ' ALA . 0.1 OUTLIER -50.51 -43.53 55.77 Favored 'General case' 0 CA--C 1.495 -1.142 0 CA-C-N 113.733 -1.576 . . . . 0.0 108.397 177.802 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.607 ' CB ' ' OG1' ' A' ' 80' ' ' THR . 43.7 m -133.11 135.51 45.29 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 113.637 -1.619 . . . . 0.0 109.48 179.906 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.77 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -125.71 163.02 23.73 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.604 0.716 . . . . 0.0 112.436 -177.88 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.782 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -132.12 30.18 4.27 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 122.704 1.24 . . . . 0.0 107.9 177.388 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.595 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.2 OUTLIER -8.69 128.15 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 112.075 -2.329 . . . . 0.0 112.148 -179.786 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.9 HG22 HG13 ' A' ' 25' ' ' ILE . 4.6 m -134.84 49.52 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.454 179.915 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.658 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 55.2 m -23.2 118.62 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.196 -179.173 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.666 ' CG1' ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -111.65 -167.39 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.726 0.774 . . . . 0.0 112.366 -179.603 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.521 ' C ' ' O ' ' A' ' 70' ' ' VAL . 1.2 mmm 16.62 -131.7 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.14 -1.391 . . . . 0.0 112.191 -179.937 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.81 -4.06 1.97 Allowed Glycine 0 N--CA 1.445 -0.74 0 CA-C-N 115.447 -0.797 . . . . 0.0 113.287 -179.63 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.583 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 130.22 28.68 0.7 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.137 -179.766 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.658 ' O ' ' HA ' ' A' ' 69' ' ' THR . 23.0 m-85 -66.13 120.42 13.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.831 0.348 . . . . 0.0 110.943 -179.644 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.505 ' HB3' ' HD3' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -99.79 115.56 29.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.804 -179.391 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.832 HG23 HG22 ' A' ' 25' ' ' ILE . 19.0 m -104.16 11.14 8.51 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.273 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.989 178.967 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.77 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 27.39 41.5 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 -177.172 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.782 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 50.3 t30 -1.23 68.09 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 113.729 -1.578 . . . . 0.0 109.149 -174.566 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.735 ' N ' ' O ' ' A' ' 77' ' ' GLU . 41.8 m170 -38.59 120.19 0.91 Allowed 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 112.57 -2.105 . . . . 0.0 113.905 -176.743 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.607 ' OG1' ' CB ' ' A' ' 64' ' ' SER . 2.2 p -105.14 -34.88 7.79 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 113.503 -1.681 . . . . 0.0 109.557 178.542 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.791 ' CB ' ' HG3' ' A' ' 63' ' ' LYS . . . -140.89 140.04 34.48 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 177.625 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 82' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.8 OUTLIER -128.09 133.71 49.06 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.59 -0.444 . . . . 0.0 111.818 -179.071 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.548 ' HB3' ' CD ' ' A' ' 63' ' ' LYS . 8.0 p80 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.673 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.425 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.806 0.336 . . . . 0.0 111.0 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 1' ' ' ALA . 1.7 Cg_endo -79.88 157.92 24.22 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.983 2.455 . . . . 0.0 112.079 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.413 ' OD1' ' C ' ' A' ' 2' ' ' PRO . 0.1 OUTLIER -165.58 -90.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.216 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 34.9 m -119.85 -168.42 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.155 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -119.12 22.49 11.83 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.253 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 60.37 -143.35 0.52 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.782 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.437 ' O ' ' O ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -139.71 95.34 8.86 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-O 120.832 0.349 . . . . 0.0 110.973 -179.888 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.515 ' O ' ' O ' ' A' ' 31' ' ' CYS . 46.5 Cg_exo -56.26 -135.27 0.0 OUTLIER 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.879 2.386 . . . . 0.0 112.298 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.586 ' HA ' ' O ' ' A' ' 31' ' ' CYS . 29.6 tt0 -122.46 157.53 31.76 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.838 0.352 . . . . 0.0 110.819 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.547 ' SG ' ' HA3' ' A' ' 30' ' ' GLY . 27.4 t -60.95 101.28 0.14 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.007 0.432 . . . . 0.0 111.074 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.751 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 7.1 t -126.29 -148.49 0.39 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.062 179.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.664 ' HG ' ' HB2' ' A' ' 79' ' ' HIS . 5.8 mp -111.25 134.72 52.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.753 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.716 ' HG3' ' HA ' ' A' ' 29' ' ' MET . 0.5 OUTLIER -98.26 51.29 1.02 Allowed 'General case' 0 CA--C 1.502 -0.868 0 CA-C-O 121.389 0.614 . . . . 0.0 111.766 -179.385 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.68 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 38.8 tt0 0.33 117.85 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 114.118 -1.401 . . . . 0.0 111.187 -179.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.771 ' HB2' HG23 ' A' ' 25' ' ' ILE . 6.7 t-20 -46.87 115.14 3.17 Favored Pre-proline 0 C--N 1.305 -1.367 0 CA-C-N 114.186 -1.37 . . . . 0.0 112.188 -179.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -80.35 16.44 1.54 Allowed 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.822 2.348 . . . . 0.0 111.262 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.642 ' CE2' ' HE2' ' A' ' 71' ' ' MET . 9.1 t80 -125.04 -55.06 1.6 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.886 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.696 ' CD2' ' CG1' ' A' ' 70' ' ' VAL . 0.4 OUTLIER -73.71 -16.17 61.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.588 179.966 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.585 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 17.1 p -52.98 79.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.524 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.598 ' N ' ' O ' ' A' ' 18' ' ' PHE . 3.3 pt20 -104.03 167.61 9.79 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.145 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -61.17 63.08 0.1 OUTLIER 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.682 2.255 . . . . 0.0 111.683 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.522 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 147.91 -8.65 1.12 Allowed Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.391 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.438 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -147.68 102.95 3.68 Favored Pre-proline 0 CA--C 1.513 -0.442 0 CA-C-O 122.071 0.939 . . . . 0.0 111.996 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.585 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 90.7 Cg_endo -104.14 65.32 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.51 0 C-N-CA 124.923 3.749 . . . . 0.0 112.795 -178.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.978 HG13 HG22 ' A' ' 68' ' ' VAL . 34.3 mm -42.23 -177.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.083 0 CA-C-N 115.198 -0.91 . . . . 0.0 113.444 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.741 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -148.23 -155.77 0.66 Allowed 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -174.719 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.523 ' CG ' ' O ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER 159.93 67.17 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 113.143 -1.844 . . . . 0.0 111.478 179.569 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.751 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.1 OUTLIER 4.8 118.33 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 114.992 -1.004 . . . . 0.0 113.425 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.716 ' HA ' ' HG3' ' A' ' 13' ' ' GLN . 3.9 ttt -58.92 -85.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.481 178.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.547 ' HA3' ' SG ' ' A' ' 10' ' ' CYS . . . 120.7 82.9 0.72 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.439 -0.886 . . . . 0.0 113.243 179.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.586 ' O ' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -168.83 47.62 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.835 0.35 . . . . 0.0 110.942 179.406 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.485 ' HA ' ' HG3' ' A' ' 9' ' ' GLU . 0.8 OUTLIER -73.54 55.04 0.48 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.886 179.87 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.624 ' CD1' ' N ' ' A' ' 33' ' ' PHE . 0.1 OUTLIER 50.26 -166.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.706 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 m -140.93 57.36 1.56 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.914 0.388 . . . . 0.0 110.832 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -65.69 142.19 58.11 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.86 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -128.24 83.2 2.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.187 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.649 ' CB ' ' HD3' ' A' ' 38' ' ' PRO . 11.6 m-85 -58.38 -72.87 0.22 Allowed Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.032 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.649 ' HD3' ' CB ' ' A' ' 37' ' ' TYR . 44.5 Cg_endo -86.61 -159.33 0.09 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.735 2.29 . . . . 0.0 111.503 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.41 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 23.2 m -78.56 117.74 68.23 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -48.43 125.36 12.16 Favored 'Trans proline' 0 N--CA 1.465 -0.196 0 C-N-CA 122.867 2.378 . . . . 0.0 112.393 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 39' ' ' THR . 0.0 OUTLIER -112.38 168.05 9.95 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.834 -179.902 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.533 ' O ' ' CB ' ' A' ' 43' ' ' SER . 0.0 OUTLIER -147.39 -166.61 2.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.416 -179.754 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 42' ' ' ARG . 8.0 t 87.36 79.97 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.776 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.422 ' O ' ' CB ' ' A' ' 45' ' ' LYS . 18.4 tptt -160.07 38.36 0.18 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.809 -179.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.542 ' O ' ' HG3' ' A' ' 47' ' ' MET . 0.3 OUTLIER 78.82 -78.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.806 -179.93 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.54 ' C ' ' O ' ' A' ' 45' ' ' LYS . 37.3 m 20.48 -91.81 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.525 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.542 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 2.1 mtt 53.49 46.52 25.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.997 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.453 ' O ' ' C ' ' A' ' 49' ' ' VAL . 0.3 OUTLIER -104.65 160.92 14.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.874 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.453 ' C ' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -35.16 107.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.523 179.668 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -69.68 56.82 0.13 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.321 -179.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.417 ' O ' ' HB2' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -113.26 68.88 0.69 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.673 179.77 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' A' ' 51' ' ' LYS . 76.6 m-20 66.32 39.55 4.02 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.678 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.1 t -141.63 25.11 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.049 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -124.47 -33.09 3.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.313 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.478 ' O ' ' O ' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -65.47 -53.82 37.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.347 -179.688 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.478 ' O ' ' O ' ' A' ' 55' ' ' SER . 0.3 OUTLIER -32.64 153.8 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.205 -179.855 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.581 ' OG ' ' N ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -135.53 -165.76 1.74 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.689 179.817 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.581 ' N ' ' OG ' ' A' ' 57' ' ' SER . 1.9 p 55.87 175.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.964 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 10.1 m -155.08 138.06 15.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.004 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.582 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 0.1 OUTLIER -113.73 120.63 41.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.034 0.445 . . . . 0.0 111.211 -179.886 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.605 ' O ' ' C ' ' A' ' 62' ' ' ALA . 23.8 t -130.25 72.63 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.165 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.605 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 17.96 95.13 0.0 OUTLIER 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.889 -178.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.899 ' N ' ' O ' ' A' ' 81' ' ' ALA . 21.7 tttm -50.3 -32.84 18.04 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-O 121.648 0.737 . . . . 0.0 109.198 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.642 ' O ' ' N ' ' A' ' 80' ' ' THR . 12.7 m -147.37 105.14 3.71 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.039 179.197 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.765 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 2.9 p90 -91.04 164.63 13.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.486 0.66 . . . . 0.0 112.072 -179.041 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.734 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 3.5 t-20 -135.71 28.95 3.24 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 122.927 1.346 . . . . 0.0 107.823 177.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.549 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -9.86 131.95 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 111.637 -2.529 . . . . 0.0 112.559 -179.48 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.978 HG22 HG13 ' A' ' 25' ' ' ILE . 14.0 m -139.36 52.24 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.323 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.676 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 50.7 m -24.62 118.3 0.05 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.564 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.696 ' CG1' ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -115.92 -168.93 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.499 0.666 . . . . 0.0 112.316 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.642 ' HE2' ' CE2' ' A' ' 17' ' ' PHE . 1.1 mtp 30.44 -137.56 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.711 -1.131 . . . . 0.0 111.034 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -71.55 14.78 1.76 Allowed Glycine 0 N--CA 1.443 -0.833 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.624 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.548 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 123.92 36.78 0.61 Allowed Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.959 -0.639 . . . . 0.0 111.881 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.676 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.7 m-85 -75.16 118.3 17.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.961 0.41 . . . . 0.0 111.096 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.48 ' HB3' ' HD3' ' A' ' 67' ' ' ARG . 0.1 OUTLIER -98.71 124.12 43.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.478 0.656 . . . . 0.0 111.393 -179.526 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.808 ' CG2' ' CG2' ' A' ' 25' ' ' ILE . 27.1 m -117.69 11.67 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.308 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.201 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.765 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.4 OUTLIER 25.81 40.54 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 -177.124 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.734 ' HB3' ' HB3' ' A' ' 66' ' ' ASN . 33.6 t30 -2.97 69.53 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 113.528 -1.669 . . . . 0.0 109.26 -174.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.715 ' HD2' ' O ' ' A' ' 77' ' ' GLU . 40.5 m170 -39.54 120.02 1.03 Allowed 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 113.068 -1.878 . . . . 0.0 113.266 -177.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.642 ' N ' ' O ' ' A' ' 64' ' ' SER . 0.6 OUTLIER -112.52 -5.65 14.02 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 113.425 -1.716 . . . . 0.0 110.325 179.606 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.899 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -171.38 83.9 0.08 Allowed 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.278 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 1.2 m -80.52 127.99 33.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.73 0.3 . . . . 0.0 110.943 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.582 ' O ' ' HA ' ' A' ' 60' ' ' CYS . 5.1 p80 -125.76 108.62 11.68 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.322 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.553 ' O ' ' CB ' ' A' ' 85' ' ' SER . 29.3 p -86.7 104.81 16.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.934 0.397 . . . . 0.0 110.602 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.574 ' OG ' ' N ' ' A' ' 86' ' ' THR . 14.4 t 153.54 -160.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.144 -179.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.574 ' N ' ' OG ' ' A' ' 85' ' ' SER . 0.2 OUTLIER 34.26 56.19 0.64 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.974 0.416 . . . . 0.0 110.482 179.901 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 3.0 t -80.63 16.31 1.42 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.369 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -174.43 -166.55 0.27 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.843 0.354 . . . . 0.0 110.88 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -126.08 151.04 47.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.017 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.477 ' O ' ' N ' ' A' ' 92' ' ' SER . 0.0 OUTLIER -110.99 -173.94 2.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.42 179.568 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.602 ' O ' ' C ' ' A' ' 92' ' ' SER . 1.0 OUTLIER 51.75 -89.04 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.505 -179.668 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.602 ' C ' ' O ' ' A' ' 91' ' ' LYS . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.294 -0.86 . . . . 0.0 111.728 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.553 ' C6 ' ' H1 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.553 ' H1 ' ' C6 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.742 ' H3 ' ' H2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.661 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . 0.661 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . 0.742 ' H2 ' ' H3 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.844 0.354 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -47.38 166.33 0.1 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.274 0 C-N-CA 122.804 2.336 . . . . 0.0 112.447 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -101.89 178.04 4.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.696 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.503 HG11 ' N ' ' A' ' 5' ' ' GLN . 70.9 t -77.6 144.81 10.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.238 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.503 ' N ' HG11 ' A' ' 4' ' ' VAL . 0.3 OUTLIER -95.01 -170.09 2.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.851 179.829 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -91.09 152.57 20.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.986 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.548 ' CB ' ' HD2' ' A' ' 8' ' ' PRO . 0.4 OUTLIER -177.47 176.23 0.51 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.754 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.548 ' HD2' ' CB ' ' A' ' 7' ' ' CYS . 83.0 Cg_exo -35.72 140.13 0.13 Allowed 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.847 2.365 . . . . 0.0 112.619 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -48.87 106.89 0.11 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.978 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.526 ' CB ' ' N ' ' A' ' 32' ' ' CYS . 0.3 OUTLIER -44.09 127.32 5.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.226 -179.868 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.694 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 10.0 t 177.47 -170.63 0.09 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.495 179.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.753 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 6.5 mp -81.22 135.37 35.74 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.0 -179.294 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.652 ' O ' ' O ' ' A' ' 14' ' ' GLU . 54.6 mt-30 -118.33 57.53 0.85 Allowed 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.365 179.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.652 ' O ' ' O ' ' A' ' 13' ' ' GLN . 6.1 tt0 7.69 119.87 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.813 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.654 HD21 ' CG2' ' A' ' 25' ' ' ILE . 3.5 t-20 -39.22 128.03 1.3 Allowed Pre-proline 0 C--N 1.309 -1.167 0 CA-C-N 114.337 -1.302 . . . . 0.0 111.837 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.465 ' HD2' ' OD1' ' A' ' 15' ' ' ASN . 94.2 Cg_endo -85.22 31.95 0.48 Allowed 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.65 2.233 . . . . 0.0 111.167 178.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.523 ' CE2' ' HG3' ' A' ' 71' ' ' MET . 22.4 t80 -148.41 -55.75 0.21 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.634 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.695 ' CD2' HG22 ' A' ' 68' ' ' VAL . 0.1 OUTLIER -70.76 -26.0 63.16 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.825 -1.079 . . . . 0.0 110.834 -179.51 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.632 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 35.9 t -50.92 81.09 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.944 -179.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.584 ' N ' ' O ' ' A' ' 18' ' ' PHE . 3.9 mm-40 -122.55 159.01 54.75 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.068 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -51.02 77.52 0.02 OUTLIER 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.748 2.299 . . . . 0.0 111.876 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 138.61 -18.63 3.21 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.601 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.504 ' O ' ' O ' ' A' ' 18' ' ' PHE . . . -147.11 102.76 3.82 Favored Pre-proline 0 CA--C 1.513 -0.475 0 CA-C-O 121.871 0.843 . . . . 0.0 111.782 -179.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.632 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 93.5 Cg_endo -105.89 64.49 0.02 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.564 0 C-N-CA 124.671 3.58 . . . . 0.0 113.603 -178.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.842 HG22 HG23 ' A' ' 76' ' ' VAL . 24.5 mm -43.4 -174.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.051 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.691 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.825 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -151.37 -161.67 1.38 Allowed 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 114.49 1.292 . . . . 0.0 114.49 -175.418 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.493 ' CB ' ' O ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER 159.72 83.51 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 112.809 -1.996 . . . . 0.0 110.9 179.104 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.694 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.0 OUTLIER -27.57 110.5 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.004 -179.405 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.589 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.7 mmt -127.59 107.11 9.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.902 0.382 . . . . 0.0 111.161 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.467 ' HA2' ' HA ' ' A' ' 10' ' ' CYS . . . 161.62 -158.88 30.76 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.999 -0.619 . . . . 0.0 112.385 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.415 ' SG ' ' C ' ' A' ' 30' ' ' GLY . 1.8 m -155.23 101.38 2.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.649 0.261 . . . . 0.0 110.871 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.526 ' N ' ' CB ' ' A' ' 10' ' ' CYS . 0.8 OUTLIER -54.12 169.54 0.17 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.571 179.939 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.527 ' CD1' ' N ' ' A' ' 33' ' ' PHE . 0.5 OUTLIER -160.15 160.87 33.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.087 -179.912 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 m -53.89 -30.46 46.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.142 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.5 mtp85 67.4 98.77 0.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.272 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -179.6 25.68 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.484 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.577 ' N ' ' CD ' ' A' ' 38' ' ' PRO . 0.3 OUTLIER -130.43 43.76 1.2 Allowed Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 120.813 0.339 . . . . 0.0 111.264 -179.845 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 37' ' ' TYR . 57.1 Cg_endo -71.1 -166.6 0.24 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.672 2.248 . . . . 0.0 112.23 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.3 t -104.36 83.8 0.8 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.321 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.95 -160.63 0.04 OUTLIER 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.739 2.293 . . . . 0.0 112.11 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.669 ' O ' ' CB ' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -76.47 -3.21 36.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.953 -179.927 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.669 ' CB ' ' O ' ' A' ' 41' ' ' LEU . 4.8 tmm_? 135.0 -50.8 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.314 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 55.0 m -45.93 115.01 0.88 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.11 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -115.89 163.98 15.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.408 179.602 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.48 48.83 19.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.967 0.413 . . . . 0.0 110.606 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.529 ' O ' ' CB ' ' A' ' 47' ' ' MET . 11.2 m -166.77 136.42 3.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.759 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.529 ' CB ' ' O ' ' A' ' 46' ' ' THR . 4.7 mtt 157.97 61.33 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.809 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.457 ' O ' ' O ' ' A' ' 47' ' ' MET . 4.4 tp 55.92 154.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.993 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.434 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -78.77 -163.06 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.108 179.951 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 53.5 42.27 31.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.133 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.426 ' HD2' ' HA ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -118.6 50.99 1.13 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.815 0.34 . . . . 0.0 111.187 -179.946 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.457 ' O ' ' C ' ' A' ' 53' ' ' VAL . 28.3 t-20 -152.1 50.75 0.79 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.034 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.457 ' C ' ' O ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -33.41 147.31 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.782 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 55' ' ' SER . 6.6 m -149.31 131.18 15.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.889 0.376 . . . . 0.0 111.176 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.501 ' O ' ' HB3' ' A' ' 56' ' ' GLU . 8.4 t 176.95 -36.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.709 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.501 ' HB3' ' O ' ' A' ' 55' ' ' SER . 0.0 OUTLIER 170.56 124.82 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.837 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.86 172.85 0.23 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.901 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.534 HG23 ' CB ' ' A' ' 84' ' ' CYS . 0.0 OUTLIER -112.3 158.46 19.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.197 -179.797 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.571 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 0.5 OUTLIER -163.11 123.58 2.31 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.888 179.758 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.652 ' O ' ' HB ' ' A' ' 61' ' ' VAL . 1.7 m -55.3 -177.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.805 -179.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.652 ' HB ' ' O ' ' A' ' 60' ' ' CYS . 9.6 p 148.28 62.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.604 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.601 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 10.28 110.02 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.511 -179.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.884 ' N ' ' O ' ' A' ' 81' ' ' ALA . 8.2 ttmt -57.01 -42.96 81.3 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.611 0.72 . . . . 0.0 109.088 178.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.531 ' O ' ' N ' ' A' ' 80' ' ' THR . 16.9 m -141.03 128.75 21.57 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.523 -1.217 . . . . 0.0 109.095 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.702 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 4.8 p90 -114.73 157.52 23.07 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -178.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.932 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -125.3 27.97 6.45 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 122.615 1.198 . . . . 0.0 108.219 176.645 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.677 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 4.2 ptp180 -8.35 103.72 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 112.36 -2.2 . . . . 0.0 111.966 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.742 ' CG1' HD13 ' A' ' 25' ' ' ILE . 3.4 m -104.02 45.93 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.393 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.68 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 28.5 m -16.33 119.05 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.63 -178.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.635 HG11 ' CE2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -113.49 -162.8 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.691 179.94 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.523 ' HG3' ' CE2' ' A' ' 17' ' ' PHE . 6.0 mtp -29.13 151.58 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.208 -1.36 . . . . 0.0 111.907 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 43.7 23.87 0.39 Allowed Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.645 -0.788 . . . . 0.0 111.966 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.47 ' C ' HG21 ' A' ' 69' ' ' THR . . . 73.77 28.84 64.25 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.163 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.68 ' O ' ' HA ' ' A' ' 69' ' ' THR . 20.3 m-85 -43.81 170.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.633 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 22.3 mtmt -153.72 93.26 1.65 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.859 0.361 . . . . 0.0 111.318 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.842 HG23 HG22 ' A' ' 25' ' ' ILE . 18.6 m -93.0 15.73 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.489 -1.391 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.764 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.722 ' O ' ' C ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER 23.42 43.72 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 -177.691 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.932 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 12.9 t-20 1.55 75.52 0.0 OUTLIER 'General case' 0 CA--C 1.499 -1.005 0 CA-C-N 114.519 -1.219 . . . . 0.0 108.043 -175.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.753 ' O ' ' CD2' ' A' ' 12' ' ' LEU . 33.6 m170 -49.19 99.58 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.419 0 CA-C-O 122.61 1.195 . . . . 0.0 111.669 -176.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.653 HG21 ' OD1' ' A' ' 78' ' ' ASN . 2.8 p -92.07 -3.5 55.66 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.55 -1.659 . . . . 0.0 109.71 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.884 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -174.33 126.75 0.34 Allowed 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.55 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.5 OUTLIER -121.47 127.91 51.56 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.987 0.422 . . . . 0.0 111.281 -179.21 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.415 ' O ' ' CD2' ' A' ' 83' ' ' HIS . 0.3 OUTLIER -140.77 137.52 33.44 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.788 -179.858 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.571 ' HA ' ' O ' ' A' ' 59' ' ' CYS . 78.2 m -91.85 137.04 32.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.851 0.358 . . . . 0.0 110.96 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.7 p -148.74 -151.88 0.41 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.834 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.552 ' HB ' ' CE1' ' A' ' 89' ' ' TYR . 5.3 m -91.06 23.71 3.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.848 0.356 . . . . 0.0 110.994 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.479 ' O ' ' O ' ' A' ' 88' ' ' TYR . 33.7 m 58.74 82.08 0.15 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.356 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.479 ' O ' ' O ' ' A' ' 87' ' ' CYS . 0.8 OUTLIER 28.96 97.21 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.479 179.439 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.552 ' CE1' ' HB ' ' A' ' 86' ' ' THR . 13.0 m-85 -52.2 -58.14 7.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.791 179.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.476 ' O ' ' O ' ' A' ' 89' ' ' TYR . 0.4 OUTLIER 39.78 -167.41 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.94 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.502 ' CG ' ' O ' ' A' ' 91' ' ' LYS . 12.8 tttm -114.25 58.68 0.69 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.946 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.0 p . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.966 180.0 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.595 ' O5 ' ' OD1' ' A' ' 78' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.541 ' H1 ' ' C6 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . 0.521 ' O2 ' ' H5 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . 0.521 ' H5 ' ' O2 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . 0.443 ' H2 ' ' H61' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.537 ' O3 ' ' O5 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.593 ' O3 ' ' H1 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . 0.593 ' H1 ' ' O3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . 0.537 ' O5 ' ' O3 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.566 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.484 1.268 0 CA-C-O 120.69 0.281 . . . . 0.0 111.22 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.566 ' HD2' ' N ' ' A' ' 1' ' ' ALA . 35.6 Cg_endo -66.07 -170.38 0.19 Allowed 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.379 2.052 . . . . 0.0 112.296 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.411 ' C ' HG21 ' A' ' 4' ' ' VAL . 0.7 OUTLIER -102.55 148.62 25.31 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.922 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.411 HG21 ' C ' ' A' ' 3' ' ' ASP . 0.7 OUTLIER -139.05 19.45 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.891 179.689 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.448 ' O ' ' HB2' ' A' ' 6' ' ' ASP . 1.2 mt-30 -155.26 -165.38 1.99 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.731 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.448 ' HB2' ' O ' ' A' ' 5' ' ' GLN . 0.5 OUTLIER 71.6 136.9 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.591 -179.81 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -45.26 161.82 0.23 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.736 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -82.31 23.38 0.79 Allowed 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.868 2.379 . . . . 0.0 112.56 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 71.97 148.96 0.09 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.955 0.407 . . . . 0.0 110.941 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.501 ' N ' ' O ' ' A' ' 31' ' ' CYS . 3.4 t -85.33 130.15 34.66 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.681 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.698 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 4.8 t -177.94 -171.32 0.28 Allowed 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.159 0.504 . . . . 0.0 111.021 179.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.72 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 8.2 mp -75.28 126.34 30.81 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.925 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.586 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.9 mt-30 -104.16 52.81 0.75 Allowed 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.948 179.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.64 ' HG3' ' HB2' ' A' ' 24' ' ' PRO . 2.1 tt0 -1.16 121.87 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.159 -1.837 . . . . 0.0 111.401 -178.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.734 ' HB2' HG23 ' A' ' 25' ' ' ILE . 0.4 OUTLIER -58.68 102.06 0.28 Allowed Pre-proline 0 C--N 1.307 -1.247 0 CA-C-N 114.348 -1.296 . . . . 0.0 112.565 -179.101 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.539 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 2.8 Cg_exo -73.45 2.37 5.8 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.267 1.978 . . . . 0.0 109.084 177.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.527 ' CE1' ' SD ' ' A' ' 71' ' ' MET . 2.1 t80 -93.3 -60.69 1.73 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 113.557 -1.656 . . . . 0.0 110.287 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.723 ' CE1' ' HB ' ' A' ' 70' ' ' VAL . 12.6 m-85 -81.35 -5.79 58.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.044 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.517 ' OG ' ' O ' ' A' ' 19' ' ' SER . 0.0 OUTLIER -52.81 89.15 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.51 179.72 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.553 ' CB ' ' CD ' ' A' ' 21' ' ' PRO . 5.3 pt20 -96.55 -176.38 0.53 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.818 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.553 ' CD ' ' CB ' ' A' ' 20' ' ' GLN . 2.9 Cg_endo -73.86 60.63 4.51 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.522 2.148 . . . . 0.0 111.402 179.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 143.12 3.35 0.9 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.661 -0.78 . . . . 0.0 113.263 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.463 ' HB3' ' H81' ' A' ' 178' ' ' NAG . . . -154.56 105.82 2.36 Favored Pre-proline 0 CA--C 1.514 -0.405 0 CA-C-O 121.894 0.854 . . . . 0.0 111.808 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.661 ' O ' ' O ' ' A' ' 25' ' ' ILE . 66.6 Cg_endo -103.4 73.08 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.392 0 C-N-CA 124.77 3.647 . . . . 0.0 113.004 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.819 ' CG2' ' H ' ' A' ' 26' ' ' LEU . 6.7 mm -38.52 -177.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.819 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -151.21 -163.66 1.82 Allowed 'General case' 0 CA--C 1.499 -1.013 0 CA-C-O 122.851 1.31 . . . . 0.0 114.262 -175.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.558 ' CG ' ' O ' ' A' ' 27' ' ' GLN . 0.3 OUTLIER 166.27 66.49 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 112.363 -2.198 . . . . 0.0 110.836 179.331 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.698 ' HA ' ' O ' ' A' ' 11' ' ' THR . 3.9 t -24.73 109.26 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.223 -179.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.515 ' HG2' ' OE1' ' A' ' 13' ' ' GLN . 3.4 ttm -147.46 125.91 12.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.078 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 169.29 -135.65 3.69 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.854 -0.688 . . . . 0.0 112.158 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.501 ' O ' ' N ' ' A' ' 10' ' ' CYS . 2.8 m -146.69 140.15 25.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.724 0.297 . . . . 0.0 110.675 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.7 p -106.76 138.38 43.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.934 0.397 . . . . 0.0 111.259 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.561 ' CD1' ' N ' ' A' ' 34' ' ' SER . 4.4 p90 -161.81 -31.87 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.688 179.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.561 ' N ' ' CD1' ' A' ' 33' ' ' PHE . 3.4 m -61.5 137.44 58.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.487 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.538 ' CG ' ' O ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER 66.49 111.66 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.782 -179.808 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.525 ' CB ' ' O ' ' A' ' 35' ' ' ARG . . . 159.64 97.41 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.383 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.438 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.5 OUTLIER -45.85 155.11 0.52 Allowed Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.191 179.608 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.438 ' C ' ' O ' ' A' ' 37' ' ' TYR . 66.8 Cg_exo -29.74 143.52 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 123.023 2.482 . . . . 0.0 112.295 179.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.9 t -112.71 130.9 23.0 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.054 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -69.76 149.79 67.37 Favored 'Trans proline' 0 C--O 1.231 0.133 0 C-N-CA 122.981 2.454 . . . . 0.0 112.391 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.46 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 2.3 tt -95.15 -9.38 33.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.688 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 41' ' ' LEU . 5.8 mtp180 166.82 133.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.127 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 30.0 m -153.89 19.83 0.52 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.612 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.26 166.04 13.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.826 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -166.86 -164.52 0.64 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.002 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -97.96 38.34 1.32 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.024 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.7 ttp -130.88 -81.61 0.53 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.917 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.508 ' HB3' ' CE ' ' A' ' 51' ' ' LYS . 0.2 OUTLIER -89.04 110.54 21.23 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.817 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.463 ' O ' ' O ' ' A' ' 48' ' ' LEU . 2.4 m -44.17 174.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.378 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.535 ' CG ' ' HB ' ' A' ' 53' ' ' VAL . 0.1 OUTLIER -33.84 118.45 0.36 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.397 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.525 ' O ' ' CB ' ' A' ' 52' ' ' ASN . 18.0 ptpt -122.73 74.44 1.2 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.409 179.617 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.525 ' CB ' ' O ' ' A' ' 51' ' ' LYS . 18.5 t30 86.58 50.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.352 -179.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.535 ' HB ' ' CG ' ' A' ' 50' ' ' GLN . 2.1 p -57.34 140.61 15.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.662 -179.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.458 ' N ' HG21 ' A' ' 53' ' ' VAL . 9.1 p -131.81 -26.21 2.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.642 179.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 m -74.08 58.52 0.69 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.81 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.436 ' OE2' ' OG ' ' A' ' 85' ' ' SER . 0.1 OUTLIER -100.36 134.79 42.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.505 179.747 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -46.92 93.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.907 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.422 ' N ' ' O ' ' A' ' 56' ' ' GLU . 0.5 OUTLIER -66.56 140.57 57.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.042 0.448 . . . . 0.0 111.002 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.485 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 0.5 OUTLIER -157.65 138.78 13.44 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.21 179.83 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.423 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -105.8 71.62 0.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.786 179.766 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.569 ' O ' ' O ' ' A' ' 62' ' ' ALA . 40.1 t -88.49 79.33 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.979 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.569 ' O ' ' O ' ' A' ' 61' ' ' VAL . . . 16.83 112.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.634 ' N ' ' O ' ' A' ' 81' ' ' ALA . 20.2 ttmt -54.16 -33.61 58.41 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.471 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 1.8 m -137.27 -175.32 4.02 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.964 178.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.683 ' HB3' ' HB3' ' A' ' 77' ' ' GLU . 1.0 OUTLIER -164.6 162.06 21.34 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.288 0.566 . . . . 0.0 111.588 -179.77 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.668 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -132.54 27.66 4.36 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.194 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.587 ' CG ' ' HA ' ' A' ' 77' ' ' GLU . 2.4 ttm105 -8.05 121.4 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 112.284 -2.235 . . . . 0.0 111.311 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.738 HG22 HG13 ' A' ' 25' ' ' ILE . 4.3 m -123.72 43.62 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.803 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.64 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 54.5 m -17.82 118.35 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.764 -178.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.723 ' HB ' ' CE1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -122.25 -169.79 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.485 -179.054 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.613 ' HG3' ' CG ' ' A' ' 74' ' ' PHE . 0.1 OUTLIER 41.54 -140.09 0.12 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.368 -179.59 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -70.63 0.34 27.68 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.811 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.429 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 136.11 40.94 0.13 Allowed Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.525 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.663 ' C ' ' HG2' ' A' ' 75' ' ' LYS . 2.4 m-85 -69.41 -179.33 1.62 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.663 ' HG2' ' C ' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -157.45 97.58 1.62 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.984 0.365 . . . . 0.0 111.984 -179.466 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.809 HG22 HG21 ' A' ' 25' ' ' ILE . 16.3 m -91.62 11.93 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.42 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.013 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.755 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 29.22 39.56 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 105.083 -2.192 . . . . 0.0 105.083 -176.601 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.687 ' N ' ' O ' ' A' ' 76' ' ' VAL . 32.7 t30 -0.14 65.45 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 112.816 -1.993 . . . . 0.0 108.378 -174.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.755 ' N ' ' O ' ' A' ' 77' ' ' GLU . 37.8 m170 -34.46 123.58 0.52 Allowed 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 112.703 -2.044 . . . . 0.0 113.43 -176.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.543 HG21 ' O ' ' A' ' 78' ' ' ASN . 6.5 p -110.78 -15.14 13.88 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 113.471 -1.695 . . . . 0.0 110.426 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.634 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -161.87 147.65 13.47 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.888 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.5 OUTLIER -127.27 154.55 44.75 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.904 0.383 . . . . 0.0 111.227 -179.98 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.438 ' O ' ' CD2' ' A' ' 83' ' ' HIS . 0.3 OUTLIER -155.66 112.86 3.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.943 -179.931 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.705 ' O ' ' CB ' ' A' ' 85' ' ' SER . 4.1 t -88.4 123.79 33.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.122 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.705 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 36.9 t 119.12 43.05 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.155 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 66.7 p -147.55 68.32 1.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.763 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 1.8 m -156.97 83.6 0.94 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.837 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.412 ' CD1' ' C ' ' A' ' 88' ' ' TYR . 8.1 p90 -92.52 141.42 28.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.905 0.383 . . . . 0.0 111.007 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.539 ' CE2' ' CD2' ' A' ' 90' ' ' HIS . 0.2 OUTLIER -168.2 172.67 8.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.669 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.539 ' CD2' ' CE2' ' A' ' 89' ' ' TYR . 8.0 m-70 26.04 72.7 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.228 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.446 ' O ' ' HG3' ' A' ' 91' ' ' LYS . 0.0 OUTLIER -110.13 4.98 21.64 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.296 -179.653 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 85.4 p . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.297 -0.858 . . . . 0.0 110.932 -179.746 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.564 ' H83' HG13 ' A' ' 68' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.56 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . 0.491 ' H3 ' ' H2 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . 0.557 ' O2 ' ' O7 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.557 ' O7 ' ' O2 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . 0.531 ' H2 ' ' O3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.771 0.319 . . . . 0.0 111.014 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.485 ' O ' ' HB3' ' A' ' 3' ' ' ASP . 45.8 Cg_exo -55.76 -164.59 0.01 OUTLIER 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.708 2.272 . . . . 0.0 112.466 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.485 ' HB3' ' O ' ' A' ' 2' ' ' PRO . 6.8 p-10 167.94 -26.83 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.687 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.519 ' O ' ' C ' ' A' ' 5' ' ' GLN . 1.5 p -32.35 119.07 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.464 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.519 ' C ' ' O ' ' A' ' 4' ' ' VAL . 7.7 pt20 23.51 60.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.508 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.429 ' HB2' ' O ' ' A' ' 4' ' ' VAL . 1.0 OUTLIER -159.45 121.1 3.32 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.838 179.91 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 31.1 p -136.05 143.65 44.95 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.955 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 7' ' ' CYS . 28.4 Cg_exo -60.79 130.46 33.16 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.68 2.253 . . . . 0.0 111.968 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.428 ' C ' ' O ' ' A' ' 8' ' ' PRO . 9.7 tt0 -35.87 129.33 0.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.031 0.443 . . . . 0.0 110.949 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.461 ' HB3' ' SG ' ' A' ' 32' ' ' CYS . 42.6 t -41.07 134.76 1.96 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.349 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.689 ' O ' ' N ' ' A' ' 29' ' ' MET . 3.3 t -173.61 -169.68 0.53 Allowed 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.37 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.631 ' CD2' ' HB2' ' A' ' 79' ' ' HIS . 7.8 mp -75.74 133.66 40.68 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.274 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.713 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.7 mt-30 -120.75 65.12 0.85 Allowed 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 121.636 0.731 . . . . 0.0 110.977 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.713 ' O ' ' O ' ' A' ' 13' ' ' GLN . 18.2 tt0 2.91 127.22 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 113.566 -1.652 . . . . 0.0 111.903 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.772 ' CG ' HG13 ' A' ' 76' ' ' VAL . 1.3 t30 -56.19 108.82 1.32 Allowed Pre-proline 0 C--N 1.307 -1.28 0 CA-C-N 113.858 -1.519 . . . . 0.0 113.339 -178.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.737 ' HD2' ' CE1' ' A' ' 17' ' ' PHE . 9.9 Cg_exo -69.95 4.95 1.97 Allowed 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.508 2.139 . . . . 0.0 112.042 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.741 ' CZ ' ' OD1' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -114.12 -56.16 2.42 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.394 178.674 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.722 ' HB3' ' CG1' ' A' ' 25' ' ' ILE . 0.3 OUTLIER -78.97 -5.58 54.18 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.888 -178.751 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.468 ' CB ' ' O ' ' A' ' 15' ' ' ASN . 2.2 t -64.91 95.28 0.15 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.746 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.575 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.1 OUTLIER -135.84 144.74 49.92 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.857 -179.649 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.562 ' CD ' ' HG3' ' A' ' 20' ' ' GLN . 1.3 Cg_endo -45.1 82.91 0.01 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.7 2.267 . . . . 0.0 111.343 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.575 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 138.35 -15.87 3.41 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.73 -179.088 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.504 ' HB2' ' H82' ' A' ' 178' ' ' NAG . . . -153.95 100.28 2.53 Favored Pre-proline 0 CA--C 1.51 -0.587 0 CA-C-O 121.958 0.885 . . . . 0.0 111.094 179.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.662 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.1 Cg_endo -103.26 60.33 0.02 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.588 0 C-N-CA 124.643 3.562 . . . . 0.0 112.78 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.917 HG13 HG22 ' A' ' 68' ' ' VAL . 23.1 mm -40.25 -176.69 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.141 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.876 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.782 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -148.87 -160.16 1.13 Allowed 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -175.105 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.476 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER 161.8 98.17 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 112.376 -2.193 . . . . 0.0 109.723 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.628 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -48.29 103.65 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.492 -0.777 . . . . 0.0 111.711 -178.531 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.689 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.0 OUTLIER -114.6 -165.21 0.99 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.47 179.512 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.11 -145.15 17.99 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.599 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -154.82 147.06 23.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.827 0.346 . . . . 0.0 110.896 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.461 ' SG ' ' HB3' ' A' ' 10' ' ' CYS . 4.1 m -100.21 -174.79 2.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.896 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -141.76 -56.96 0.47 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.782 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.445 ' OG ' ' N ' ' A' ' 35' ' ' ARG . 24.4 p -166.6 -132.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.594 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.445 ' N ' ' OG ' ' A' ' 34' ' ' SER . 4.4 ttt180 -166.12 100.88 0.64 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.842 0.353 . . . . 0.0 110.957 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.485 ' O ' ' C ' ' A' ' 37' ' ' TYR . . . 56.24 158.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.453 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.485 ' C ' ' O ' ' A' ' 36' ' ' ALA . 3.0 m-30 28.58 74.76 0.38 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.238 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.437 ' O ' ' O ' ' A' ' 39' ' ' THR . 30.6 Cg_endo -65.07 -3.77 7.79 Favored 'Trans proline' 0 CA--C 1.515 -0.433 0 C-N-CA 122.826 2.35 . . . . 0.0 112.513 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.437 ' O ' ' O ' ' A' ' 38' ' ' PRO . 69.0 p 45.63 100.5 0.03 OUTLIER Pre-proline 0 C--N 1.313 -1.003 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.702 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.493 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 36.2 Cg_exo -61.36 -165.23 0.04 OUTLIER 'Trans proline' 0 C--O 1.231 0.131 0 C-N-CA 122.854 2.369 . . . . 0.0 111.78 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.493 ' HB2' ' O ' ' A' ' 40' ' ' PRO . 26.1 mt 66.56 142.8 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.888 0.375 . . . . 0.0 110.899 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -118.45 68.91 0.79 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.817 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 88.4 p -108.86 49.49 0.81 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.067 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.88 98.24 6.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.643 179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.42 92.59 7.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.168 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.445 ' C ' ' CG ' ' A' ' 47' ' ' MET . 1.3 t -56.41 171.17 0.31 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.906 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.445 ' CG ' ' C ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -163.76 34.47 0.08 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.871 179.886 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.471 ' O ' ' O ' ' A' ' 49' ' ' VAL . 34.4 tp -146.37 101.31 3.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.005 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.471 ' O ' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER 53.53 116.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.108 -179.907 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -97.06 37.04 1.35 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.089 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -121.21 29.05 7.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.826 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.486 ' O ' ' O ' ' A' ' 53' ' ' VAL . 3.8 m-20 81.28 89.2 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.897 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.486 ' O ' ' O ' ' A' ' 52' ' ' ASN . 2.8 m -49.38 -171.57 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.195 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.2 p -80.06 -153.47 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.918 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.9 m -112.74 111.82 22.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.868 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.46 69.63 1.2 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.941 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.9 p -149.73 -98.0 0.07 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.131 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.484 ' HB ' ' SG ' ' A' ' 84' ' ' CYS . 1.1 p -106.68 -173.16 2.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.956 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.55 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 0.7 OUTLIER 170.44 112.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.347 179.535 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.469 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 0.1 OUTLIER -77.88 115.48 17.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.964 179.827 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.624 ' O ' ' C ' ' A' ' 62' ' ' ALA . 47.8 t -133.51 71.93 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.713 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.624 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 0.3 103.36 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.696 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.791 ' N ' ' O ' ' A' ' 81' ' ' ALA . 1.6 ttmm -54.84 -38.74 67.81 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.545 ' O ' ' N ' ' A' ' 80' ' ' THR . 15.5 m -140.94 117.0 10.52 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.779 -1.101 . . . . 0.0 109.717 178.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.71 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 2.8 p90 -107.57 161.99 14.36 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.283 -178.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.811 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 1.0 OUTLIER -129.69 28.13 5.16 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 122.357 1.075 . . . . 0.0 108.173 177.11 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.721 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -11.85 115.81 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 112.565 -2.107 . . . . 0.0 111.734 -179.899 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.917 HG22 HG13 ' A' ' 25' ' ' ILE . 3.8 m -120.14 48.12 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 114.867 -1.06 . . . . 0.0 110.737 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.637 ' C ' ' O ' ' A' ' 68' ' ' VAL . 5.8 m -14.05 118.84 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.079 -179.062 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.671 ' CG1' ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -107.52 -162.42 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.799 0.809 . . . . 0.0 111.729 -179.8 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.539 ' O ' ' CD1' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -32.66 151.45 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.929 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 48.01 19.23 0.95 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.15 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.521 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 70.82 30.26 68.41 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.303 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.58 ' O ' ' HA ' ' A' ' 69' ' ' THR . 5.8 m-30 -51.67 -174.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.803 0.335 . . . . 0.0 111.007 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -158.97 121.05 3.49 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.274 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.812 HG22 HG21 ' A' ' 25' ' ' ILE . 19.6 m -118.18 12.08 7.11 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.494 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.437 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.724 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 28.26 39.71 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 -177.05 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.811 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 49.2 t30 -0.8 68.49 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.899 0 CA-C-N 113.531 -1.668 . . . . 0.0 108.55 -174.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.724 ' N ' ' O ' ' A' ' 77' ' ' GLU . 39.4 m170 -39.48 118.01 0.78 Allowed 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 113.198 -1.819 . . . . 0.0 114.1 -176.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.64 HG21 ' O ' ' A' ' 78' ' ' ASN . 1.0 OUTLIER -109.12 -17.01 13.98 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 113.379 -1.737 . . . . 0.0 109.487 178.792 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.791 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -162.88 136.93 6.19 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.263 -0.88 . . . . 0.0 108.942 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -125.9 140.98 52.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.706 0.289 . . . . 0.0 110.636 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.623 ' CE1' ' CG2' ' A' ' 86' ' ' THR . 0.5 OUTLIER -136.6 114.43 11.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.98 0.419 . . . . 0.0 111.502 -179.794 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.628 ' O ' ' CB ' ' A' ' 85' ' ' SER . 0.1 OUTLIER -91.08 133.58 35.21 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.478 179.587 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.628 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 4.9 t 98.22 17.11 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.993 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.623 ' CG2' ' CE1' ' A' ' 83' ' ' HIS . 9.1 t -96.3 33.81 1.71 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.431 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 18.2 m -84.02 60.19 5.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.194 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.415 ' O ' ' O ' ' A' ' 89' ' ' TYR . 4.1 m-30 -124.46 121.64 35.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.797 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.415 ' O ' ' O ' ' A' ' 88' ' ' TYR . 14.5 m-30 -39.09 160.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.034 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -98.73 64.44 1.48 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.124 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -110.43 98.1 7.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.716 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.216 -0.897 . . . . 0.0 111.029 -179.813 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.669 ' H83' HG13 ' A' ' 68' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.614 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . 0.471 ' H1 ' ' O6 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.621 ' O3 ' ' H1 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . 0.621 ' H1 ' ' O3 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.443 ' HB3' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 121.013 0.435 . . . . 0.0 111.055 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.443 ' HD2' ' HB3' ' A' ' 1' ' ' ALA . 4.1 Cg_endo -46.8 172.47 0.03 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 123.236 2.624 . . . . 0.0 112.453 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -119.78 -53.55 2.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.984 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 34.7 m -124.17 -146.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.803 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -102.59 139.77 37.75 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.75 0.309 . . . . 0.0 111.236 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.482 ' O ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -160.65 178.95 8.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.856 179.858 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.482 ' O ' ' O ' ' A' ' 6' ' ' ASP . 0.1 OUTLIER 56.02 150.7 0.06 OUTLIER Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.607 -179.652 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.472 ' O ' ' O ' ' A' ' 31' ' ' CYS . 11.7 Cg_endo -55.17 -164.2 0.01 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.495 2.13 . . . . 0.0 111.875 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.569 ' OE1' ' CZ ' ' A' ' 33' ' ' PHE . 0.1 OUTLIER -117.87 161.76 19.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.057 0.456 . . . . 0.0 111.143 -179.892 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.474 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 47.3 t -61.63 125.27 23.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.382 -179.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.614 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 1.0 OUTLIER -149.75 -144.11 0.15 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.521 179.492 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.66 ' HG ' ' HB2' ' A' ' 79' ' ' HIS . 6.1 mp -122.27 138.19 54.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.154 0.502 . . . . 0.0 111.093 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.63 ' O ' ' C ' ' A' ' 14' ' ' GLU . 1.6 mt-30 -96.15 44.97 1.07 Allowed 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.197 -179.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.668 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 21.8 tt0 -2.53 116.63 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 114.143 -1.389 . . . . 0.0 110.66 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.757 ' HB2' HG23 ' A' ' 25' ' ' ILE . 0.9 OUTLIER -56.03 103.1 0.34 Allowed Pre-proline 0 C--N 1.304 -1.4 0 CA-C-N 114.223 -1.353 . . . . 0.0 112.367 -178.8 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.552 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 72.6 Cg_endo -75.37 10.27 1.89 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.247 1.965 . . . . 0.0 109.887 177.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.576 ' CZ ' ' SD ' ' A' ' 71' ' ' MET . 0.8 OUTLIER -106.06 -59.55 1.76 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.212 -1.358 . . . . 0.0 110.879 -179.478 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.723 ' CG ' HG22 ' A' ' 70' ' ' VAL . 8.8 m-85 -80.34 -1.71 42.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.822 -179.032 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.442 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 27.4 t -48.94 93.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.841 0.353 . . . . 0.0 110.179 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.543 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.1 OUTLIER -91.43 168.38 13.56 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.921 -179.566 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.407 ' CD ' ' HB3' ' A' ' 20' ' ' GLN . 27.2 Cg_exo -62.55 59.69 0.14 Allowed 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.708 2.272 . . . . 0.0 111.462 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.543 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 138.62 5.21 1.51 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.898 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.605 ' CB ' ' H81' ' A' ' 178' ' ' NAG . . . -150.98 101.69 3.02 Favored Pre-proline 0 CA--C 1.511 -0.543 0 CA-C-O 122.082 0.944 . . . . 0.0 111.938 -179.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.64 ' O ' HD22 ' A' ' 26' ' ' LEU . 18.6 Cg_endo -96.17 81.24 0.1 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.464 0 C-N-CA 124.504 3.469 . . . . 0.0 112.708 -179.279 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.832 ' CG2' ' H ' ' A' ' 26' ' ' LEU . 12.6 mm -42.01 -175.59 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.832 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -153.72 -160.37 1.1 Allowed 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 -175.229 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.539 ' O ' ' O ' ' A' ' 28' ' ' CYS . 1.8 tt0 162.53 64.06 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 112.523 -2.126 . . . . 0.0 111.429 179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.63 ' HB2' ' ND1' ' A' ' 79' ' ' HIS . 0.6 OUTLIER 6.91 121.0 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 179.772 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.596 ' HA ' ' CG ' ' A' ' 13' ' ' GLN . 3.2 ttp -65.82 -72.3 0.16 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.904 177.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.443 ' N ' ' CG ' ' A' ' 29' ' ' MET . . . 102.02 104.72 2.81 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.731 -0.747 . . . . 0.0 113.112 179.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.547 ' O ' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -164.45 66.07 0.15 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.803 0.335 . . . . 0.0 110.882 179.387 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.474 ' SG ' ' HB2' ' A' ' 10' ' ' CYS . 85.2 m -97.65 -151.16 0.36 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.548 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.569 ' CZ ' ' OE1' ' A' ' 9' ' ' GLU . 0.7 OUTLIER -129.83 -162.75 1.23 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.667 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.621 ' O ' ' CB ' ' A' ' 35' ' ' ARG . 0.1 OUTLIER -138.7 123.8 19.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.299 -179.698 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.621 ' CB ' ' O ' ' A' ' 34' ' ' SER . 0.4 OUTLIER 146.83 -172.21 0.0 OUTLIER 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.015 179.568 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.583 ' O ' ' CD2' ' A' ' 37' ' ' TYR . . . -174.0 109.2 0.14 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.009 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.583 ' CD2' ' O ' ' A' ' 36' ' ' ALA . 18.6 m-85 -169.9 106.51 0.45 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.042 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -52.01 174.6 0.08 OUTLIER 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.947 2.432 . . . . 0.0 112.561 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.401 ' HA ' ' HD2' ' A' ' 40' ' ' PRO . 49.6 m -51.84 123.02 23.85 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.22 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.474 ' O ' ' C ' ' A' ' 41' ' ' LEU . 13.1 Cg_endo -57.38 169.51 2.2 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.744 2.296 . . . . 0.0 111.911 179.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.474 ' C ' ' O ' ' A' ' 40' ' ' PRO . 2.5 mt -31.27 -61.12 0.21 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.005 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.471 ' O ' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -42.17 170.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.973 -179.858 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.529 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -113.48 -66.13 1.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.992 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.529 ' HB2' ' O ' ' A' ' 43' ' ' SER . 1.7 mttm 73.04 -106.96 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.973 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.55 ' O ' ' OG1' ' A' ' 46' ' ' THR . 0.1 OUTLIER -126.82 -159.88 0.96 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.784 0.326 . . . . 0.0 111.177 -179.564 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.55 ' OG1' ' O ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER 70.67 48.0 0.45 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.979 -179.77 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.462 ' C ' ' O ' ' A' ' 46' ' ' THR . 6.2 mtp 32.23 -134.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.001 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.5 mt -138.43 -170.04 2.73 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.629 0.252 . . . . 0.0 110.92 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER 60.97 117.84 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.619 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.405 ' O ' ' NZ ' ' A' ' 51' ' ' LYS . 1.2 mm100 -70.63 145.03 50.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.116 -179.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.49 ' HA ' ' HD3' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -118.81 33.7 5.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.773 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.58 159.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.385 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.407 ' C ' ' OG1' ' A' ' 54' ' ' THR . 0.0 OUTLIER -138.8 13.01 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.371 -179.953 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.454 ' HB ' ' CB ' ' A' ' 85' ' ' SER . 0.0 OUTLIER 58.45 45.15 17.02 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.002 179.982 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.495 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -49.28 162.84 0.12 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.373 -179.837 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.495 ' HB2' ' O ' ' A' ' 55' ' ' SER . 0.1 OUTLIER 83.92 90.63 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.394 179.572 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 59.9 179.72 0.09 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.547 179.447 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.463 ' HA ' ' HA ' ' A' ' 85' ' ' SER . 9.6 p -148.71 165.04 32.58 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.821 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.47 ' O ' ' N ' ' A' ' 85' ' ' SER . 0.2 OUTLIER 163.66 127.09 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.903 0.382 . . . . 0.0 111.075 179.789 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.543 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 3.6 m -86.32 140.7 29.82 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.072 0.463 . . . . 0.0 111.544 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.53 ' O ' ' O ' ' A' ' 62' ' ' ALA . 73.2 t -157.48 55.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.027 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.557 ' HA ' ' O ' ' A' ' 81' ' ' ALA . . . 31.87 103.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.891 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.768 ' N ' ' O ' ' A' ' 81' ' ' ALA . 3.1 tptt -51.92 -36.33 48.63 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.706 0.765 . . . . 0.0 109.23 178.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.612 ' O ' ' N ' ' A' ' 80' ' ' THR . 74.9 m -150.08 118.84 6.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.39 -1.277 . . . . 0.0 109.919 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.798 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -105.23 166.31 10.5 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.531 0.681 . . . . 0.0 112.293 -178.811 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.761 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 0.1 OUTLIER -130.9 27.09 4.93 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-O 122.593 1.187 . . . . 0.0 107.921 177.399 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.688 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 12.9 ptt85 -11.0 100.7 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 112.475 -2.148 . . . . 0.0 111.689 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.707 HG23 ' CD1' ' A' ' 25' ' ' ILE . 4.2 m -98.32 45.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 CA-C-N 114.939 -1.028 . . . . 0.0 110.502 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.656 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 53.0 m -21.52 118.9 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.027 -179.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.723 HG22 ' CG ' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -126.12 -167.49 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.784 0.802 . . . . 0.0 112.474 -178.457 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.601 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 0.0 OUTLIER 39.17 -132.73 0.18 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.969 -179.888 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -78.97 19.65 5.13 Favored Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.735 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 113.06 41.43 0.98 Allowed Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.634 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.656 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.2 m-85 -72.53 178.6 3.96 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.585 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 5.9 mtmm -155.14 108.23 2.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.193 0.521 . . . . 0.0 111.454 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.822 HG23 HG22 ' A' ' 25' ' ' ILE . 15.4 m -106.59 15.02 7.52 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.483 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.337 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.798 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.6 OUTLIER 28.41 40.21 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 105.787 -1.931 . . . . 0.0 105.787 -176.876 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.761 ' HB3' ' HB3' ' A' ' 66' ' ' ASN . 29.1 t30 -4.89 68.92 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 113.402 -1.726 . . . . 0.0 108.722 -174.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.787 ' N ' ' O ' ' A' ' 77' ' ' GLU . 36.4 m170 -37.77 122.11 0.95 Allowed 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 112.945 -1.934 . . . . 0.0 113.909 -176.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.612 ' N ' ' O ' ' A' ' 64' ' ' SER . 2.1 p -109.12 -11.73 14.9 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 113.048 -1.887 . . . . 0.0 109.211 178.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.768 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -172.38 142.49 1.31 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.4 179.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 8.1 m -120.82 146.22 46.78 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.679 0.276 . . . . 0.0 110.494 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.543 ' O ' ' HA ' ' A' ' 60' ' ' CYS . 0.8 OUTLIER -138.51 114.02 9.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.816 0.341 . . . . 0.0 111.8 -179.061 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.538 ' O ' ' CB ' ' A' ' 85' ' ' SER . 0.1 OUTLIER -77.69 89.09 3.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.803 179.415 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 3.0 p 158.25 94.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.106 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.467 HG21 HG22 ' A' ' 61' ' ' VAL . 4.4 t 170.94 47.39 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.946 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -117.4 126.03 51.97 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.038 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -73.74 73.05 1.53 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.647 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -93.17 -167.55 1.74 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.428 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.52 ' O ' ' ND1' ' A' ' 90' ' ' HIS . 40.1 t-80 -142.23 71.21 1.34 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.786 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.484 ' O ' ' CB ' ' A' ' 92' ' ' SER . 0.2 OUTLIER -130.73 -78.27 0.53 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.79 179.955 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.484 ' CB ' ' O ' ' A' ' 91' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.872 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.64 ' H62' ' H1 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.64 ' H1 ' ' H62' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . 0.531 ' H1 ' ' H62' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.571 ' O6 ' ' H1 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.835 ' H3 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . 0.835 ' O2 ' ' H3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . 0.571 ' H1 ' ' O6 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.489 ' N ' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.893 0.377 . . . . 0.0 111.011 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.489 ' CD ' ' N ' ' A' ' 1' ' ' ALA . 24.4 Cg_exo -63.03 -165.43 0.05 OUTLIER 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.853 2.369 . . . . 0.0 112.039 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -75.65 -62.64 1.51 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.67 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.458 HG12 ' O ' ' A' ' 4' ' ' VAL . 1.4 p -153.27 17.71 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.188 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -88.48 172.63 9.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.779 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -98.91 149.6 22.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.046 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -139.42 140.92 27.1 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.488 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -86.5 -177.88 2.51 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 122.87 2.38 . . . . 0.0 112.528 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.44 ' HG2' ' N ' ' A' ' 10' ' ' CYS . 0.9 OUTLIER -86.14 137.81 32.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.031 0.443 . . . . 0.0 110.957 -179.834 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.44 ' N ' ' HG2' ' A' ' 9' ' ' GLU . 12.6 t -43.79 115.14 0.75 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.427 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.625 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 3.9 t -175.86 -169.48 0.34 Allowed 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 121.183 0.516 . . . . 0.0 111.106 179.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.912 HD22 ' O ' ' A' ' 79' ' ' HIS . 8.0 mp -85.9 130.31 34.58 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.465 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.614 ' O ' ' C ' ' A' ' 14' ' ' GLU . 2.0 mt-30 -91.39 49.01 1.54 Allowed 'General case' 0 CA--C 1.5 -0.95 0 CA-C-O 121.905 0.86 . . . . 0.0 110.278 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.614 ' C ' ' O ' ' A' ' 13' ' ' GLN . 27.5 tt0 -1.15 113.81 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 113.339 -1.755 . . . . 0.0 110.864 -178.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.723 ' HB2' HG23 ' A' ' 25' ' ' ILE . 1.4 t-20 -41.0 100.69 0.23 Allowed Pre-proline 0 C--N 1.301 -1.528 0 CA-C-N 113.293 -1.776 . . . . 0.0 112.349 -179.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -68.74 4.83 1.56 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.272 1.981 . . . . 0.0 110.664 178.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.587 ' CZ ' ' HG3' ' A' ' 71' ' ' MET . 10.9 t80 -110.63 -56.47 2.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.965 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.641 ' CG ' HG13 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -73.16 -26.53 61.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.535 179.777 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.514 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 8.9 m -47.26 97.57 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.928 -179.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.627 ' O ' ' N ' ' A' ' 22' ' ' GLY . 8.7 tt0 -136.04 139.7 31.01 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.443 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.501 ' HD2' ' HG3' ' A' ' 20' ' ' GLN . 87.9 Cg_exo -35.36 81.84 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.747 2.298 . . . . 0.0 112.417 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.627 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 130.93 -6.32 5.76 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.503 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.456 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . -159.73 101.65 1.47 Allowed Pre-proline 0 CA--C 1.513 -0.463 0 CA-C-O 121.992 0.901 . . . . 0.0 111.862 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.654 ' HD2' ' H3 ' ' A' ' 178' ' ' NAG . 91.6 Cg_endo -106.24 65.94 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.506 0 C-N-CA 124.981 3.787 . . . . 0.0 113.469 -178.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.798 HG21 HG22 ' A' ' 76' ' ' VAL . 16.2 mm -41.81 -176.41 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.368 179.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.792 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -150.62 -160.52 1.18 Allowed 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -175.403 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 17.5 tt0 166.25 63.01 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 112.706 -2.043 . . . . 0.0 110.998 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.625 ' HA ' ' O ' ' A' ' 11' ' ' THR . 94.3 m -20.1 111.73 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.733 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.534 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -159.21 104.48 1.68 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.927 179.274 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -149.28 -133.79 2.26 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.602 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.2 m -153.4 122.51 6.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.684 0.278 . . . . 0.0 110.73 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 3.3 m -92.57 109.86 21.27 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.848 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -101.5 157.94 16.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.336 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.6 t 177.19 -71.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.593 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.2 mtp180 39.21 -160.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.104 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.55 ' O ' ' CB ' ' A' ' 37' ' ' TYR . . . -75.04 103.0 5.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.366 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.55 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 15.2 t80 153.28 65.59 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.7 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.67 176.13 10.49 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 C-N-CA 122.747 2.298 . . . . 0.0 112.595 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.436 ' O ' ' HB3' ' A' ' 43' ' ' SER . 4.3 p -150.03 169.08 9.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.858 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.418 ' CD ' ' HB ' ' A' ' 39' ' ' THR . 11.9 Cg_exo -70.17 -24.6 27.6 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.936 2.424 . . . . 0.0 112.057 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -97.49 51.98 1.1 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.782 -179.892 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 1.3 tmm_? 167.88 -26.0 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.269 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.436 ' HB3' ' O ' ' A' ' 39' ' ' THR . 29.2 t -118.93 17.39 13.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.356 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? 54.97 -165.99 0.1 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.604 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -102.68 -22.79 13.9 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.787 0.327 . . . . 0.0 111.051 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -113.22 160.43 18.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.098 0.475 . . . . 0.0 111.344 -179.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.582 ' HG2' ' O ' ' A' ' 47' ' ' MET . 0.0 OUTLIER -176.52 93.69 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.534 179.549 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.458 ' C ' ' CG2' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -103.82 72.78 1.13 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.27 -179.491 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.458 ' CG2' ' C ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER 55.03 166.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.929 0.395 . . . . 0.0 111.247 179.728 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -169.86 140.96 2.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.732 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.4 ' O ' ' HB2' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -61.48 133.08 55.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.142 -179.722 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.4 ' HB2' ' O ' ' A' ' 51' ' ' LYS . 5.8 m120 64.71 107.62 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.089 179.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.499 ' O ' ' CB ' ' A' ' 54' ' ' THR . 35.4 t -140.32 153.66 22.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.296 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.565 ' CG2' ' O ' ' A' ' 54' ' ' THR . 0.4 OUTLIER 84.8 109.9 0.05 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.816 179.748 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.479 ' O ' ' C ' ' A' ' 56' ' ' GLU . 3.5 p -123.09 93.08 3.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.55 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.479 ' C ' ' O ' ' A' ' 55' ' ' SER . 0.1 OUTLIER -28.97 -96.07 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.52 -179.696 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -121.4 130.86 53.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.852 0.358 . . . . 0.0 111.013 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.488 ' HA ' ' HA ' ' A' ' 86' ' ' THR . 42.1 p -106.07 -176.67 3.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.086 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.55 ' SG ' ' N ' ' A' ' 87' ' ' CYS . 0.3 OUTLIER -157.97 126.03 5.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.384 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.423 ' HB3' ' HB2' ' A' ' 82' ' ' CYS . 0.6 OUTLIER -75.89 104.07 6.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.595 -179.499 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.518 ' O ' ' C ' ' A' ' 62' ' ' ALA . 18.0 t -102.38 73.7 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.342 179.09 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.556 ' HA ' ' O ' ' A' ' 81' ' ' ALA . . . 13.0 99.65 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -179.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.925 ' N ' ' O ' ' A' ' 81' ' ' ALA . 0.9 OUTLIER -50.29 -35.24 26.5 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.307 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.491 ' CB ' ' OG1' ' A' ' 80' ' ' THR . 22.6 m -136.28 -174.88 3.81 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 113.768 -1.56 . . . . 0.0 108.877 179.164 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.707 ' HB3' ' HB3' ' A' ' 77' ' ' GLU . 1.8 p90 -164.05 162.97 23.38 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.498 0.666 . . . . 0.0 112.331 -179.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.819 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -134.99 29.36 3.43 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 176.468 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.715 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 1.8 ptt85 -10.76 130.0 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 112.109 -2.314 . . . . 0.0 112.368 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.768 HG22 HG13 ' A' ' 25' ' ' ILE . 2.5 m -135.28 38.2 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.094 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.587 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 23.1 m -4.5 119.23 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.661 -1.154 . . . . 0.0 112.336 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.637 HG11 ' CE2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -111.16 -161.29 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-O 121.78 0.8 . . . . 0.0 111.593 179.108 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.587 ' HG3' ' CZ ' ' A' ' 17' ' ' PHE . 3.7 mtt -30.89 153.6 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.901 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 42.13 25.85 0.29 Allowed Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.46 -0.876 . . . . 0.0 111.552 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.495 ' O ' ' O ' ' A' ' 74' ' ' PHE . . . 68.96 30.82 72.22 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.128 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.587 ' O ' ' HA ' ' A' ' 69' ' ' THR . 8.0 m-30 -46.59 179.36 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.625 0.25 . . . . 0.0 110.331 179.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.53 ' CG ' ' O ' ' A' ' 74' ' ' PHE . 9.7 mtpt -161.58 93.0 0.9 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.133 0.492 . . . . 0.0 111.432 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.798 HG22 HG21 ' A' ' 25' ' ' ILE . 27.3 m -85.82 9.1 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.486 -1.488 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.903 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.738 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 29.49 39.62 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 -177.084 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.819 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 61.3 t30 3.91 62.15 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 113.123 -1.853 . . . . 0.0 108.448 -174.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.912 ' O ' HD22 ' A' ' 12' ' ' LEU . 35.7 m170 -31.7 120.95 0.27 Allowed 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 112.778 -2.01 . . . . 0.0 113.7 -176.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.491 ' OG1' ' CB ' ' A' ' 64' ' ' SER . 7.5 p -107.7 -10.88 15.53 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 113.84 -1.527 . . . . 0.0 110.1 179.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.925 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -170.44 133.03 1.02 Allowed 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.908 178.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.594 ' SG ' ' CD1' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -116.67 142.38 46.97 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.27 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.469 ' CG ' ' O ' ' A' ' 83' ' ' HIS . 0.6 OUTLIER -126.1 115.17 19.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.816 0.341 . . . . 0.0 110.828 179.635 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 68.3 m -58.8 105.76 0.34 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.026 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.488 ' O ' ' SG ' ' A' ' 59' ' ' CYS . 0.9 OUTLIER -144.42 115.5 7.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.139 179.907 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.488 ' HA ' ' HA ' ' A' ' 58' ' ' THR . 0.2 OUTLIER -30.87 153.5 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.359 179.861 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.55 ' N ' ' SG ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER -115.25 46.09 1.52 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.713 179.759 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.426 ' O ' ' C ' ' A' ' 89' ' ' TYR . 1.2 m-30 -119.38 62.72 0.8 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.767 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 88' ' ' TYR . 0.4 OUTLIER 36.21 80.81 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.738 -179.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -148.43 135.3 19.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.929 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -118.87 102.43 8.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.828 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.275 -0.869 . . . . 0.0 110.808 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.654 ' H3 ' ' HD2' ' A' ' 24' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.448 ' H62' ' H1 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . 0.448 ' H1 ' ' H62' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.752 ' H5 ' ' H2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.46 ' H3 ' ' O7 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . 0.442 ' H1 ' ' H62' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . 0.752 ' H2 ' ' H5 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.872 0.367 . . . . 0.0 111.042 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -62.23 120.76 8.48 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.649 2.233 . . . . 0.0 111.83 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -88.01 47.2 1.47 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.355 -179.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.562 ' O ' ' O ' ' A' ' 5' ' ' GLN . 1.0 OUTLIER -106.9 -0.58 9.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.941 0.4 . . . . 0.0 110.898 179.574 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.562 ' O ' ' O ' ' A' ' 4' ' ' VAL . 0.2 OUTLIER 29.11 -154.64 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.153 179.723 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 41.22 64.88 0.91 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.075 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -44.44 136.6 4.19 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 120.822 0.344 . . . . 0.0 110.729 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.444 ' HD2' ' SG ' ' A' ' 31' ' ' CYS . 35.0 Cg_endo -64.54 -160.77 0.04 OUTLIER 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.703 2.269 . . . . 0.0 112.213 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 56.1 tt0 -93.9 158.15 15.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.536 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.439 ' HB2' ' C ' ' A' ' 31' ' ' CYS . 14.6 t -100.3 147.22 26.02 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.031 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.63 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 3.7 t -178.92 -167.76 0.12 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.419 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.652 ' CD2' ' HB2' ' A' ' 79' ' ' HIS . 3.9 mp -97.2 139.21 33.51 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.392 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.634 ' O ' ' O ' ' A' ' 14' ' ' GLU . 28.7 mt-30 -111.24 55.04 0.66 Allowed 'General case' 0 CA--C 1.505 -0.752 0 CA-C-O 121.658 0.742 . . . . 0.0 110.736 179.093 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.634 ' O ' ' O ' ' A' ' 13' ' ' GLN . 14.7 tt0 -0.16 122.63 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 113.651 -1.613 . . . . 0.0 111.311 -179.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.833 ' HB2' HG23 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -63.46 102.69 0.34 Allowed Pre-proline 0 C--N 1.305 -1.341 0 CA-C-N 114.107 -1.406 . . . . 0.0 112.7 -179.015 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.552 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 6.3 Cg_exo -76.72 5.09 5.08 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.632 2.221 . . . . 0.0 109.41 177.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.503 ' HB3' ' OD1' ' A' ' 15' ' ' ASN . 0.9 OUTLIER -96.85 -62.28 1.28 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 113.86 -1.518 . . . . 0.0 110.525 -179.668 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.677 ' CD2' ' CG ' ' A' ' 15' ' ' ASN . 7.3 m-85 -77.76 -4.86 48.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.86 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.484 ' HA ' ' O ' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -52.23 91.52 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.127 179.477 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.673 ' O ' ' N ' ' A' ' 22' ' ' GLY . 4.6 mt-30 -95.09 162.59 24.39 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.357 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.576 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 11.4 Cg_endo -54.86 63.48 0.03 OUTLIER 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.761 2.307 . . . . 0.0 111.802 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.673 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 143.53 1.08 1.07 Allowed Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.805 -0.712 . . . . 0.0 113.133 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.582 ' HB2' ' C8 ' ' A' ' 178' ' ' NAG . . . -155.13 108.61 2.27 Favored Pre-proline 0 CA--C 1.518 -0.258 0 CA-C-O 122.074 0.94 . . . . 0.0 112.804 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.813 ' HD2' ' H3 ' ' A' ' 178' ' ' NAG . 94.9 Cg_endo -98.78 78.52 0.05 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.073 0 C-N-CA 124.844 3.696 . . . . 0.0 112.913 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.862 HG21 ' H ' ' A' ' 26' ' ' LEU . 5.1 mm -43.9 -176.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.862 ' H ' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.21 -164.87 2.07 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 122.343 1.068 . . . . 0.0 113.612 -176.297 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.654 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER 165.55 78.87 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 112.939 -1.937 . . . . 0.0 111.051 178.868 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.63 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -13.35 114.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.265 -179.851 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.589 ' N ' ' O ' ' A' ' 11' ' ' THR . 9.8 mmm -126.99 123.87 38.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.885 0.374 . . . . 0.0 111.241 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 136.72 -145.48 17.34 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.382 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.444 ' SG ' ' HD2' ' A' ' 8' ' ' PRO . 1.6 p -163.21 170.38 17.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.82 0.343 . . . . 0.0 110.811 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.45 -167.49 0.18 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.809 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.442 ' CD1' ' N ' ' A' ' 33' ' ' PHE . 3.3 m-85 -106.14 -159.13 0.69 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.546 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.7 p -148.58 -158.92 0.96 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.835 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.472 ' CG ' ' O ' ' A' ' 35' ' ' ARG . 1.6 ptm180 -105.19 36.94 2.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.723 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 60.6 151.13 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.899 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.421 ' O ' ' O ' ' A' ' 38' ' ' PRO . 47.0 t80 -137.01 78.78 39.99 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.7 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.421 ' O ' ' O ' ' A' ' 37' ' ' TYR . 52.8 Cg_exo -53.54 -159.02 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.855 2.37 . . . . 0.0 112.238 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -121.36 63.84 13.84 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.638 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -62.58 118.51 5.41 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.84 2.36 . . . . 0.0 112.183 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.9 mt -114.26 -161.69 0.78 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.237 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.45 ' O ' ' CG ' ' A' ' 42' ' ' ARG . 5.9 tpt180 -85.52 55.16 3.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.652 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 39.1 t -143.32 -74.64 0.27 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.791 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -146.37 -160.88 1.21 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.854 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.64 95.2 2.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.775 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.415 ' O ' HD11 ' A' ' 48' ' ' LEU . 20.1 p -96.73 -153.66 0.42 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.018 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.4 ' C ' ' O ' ' A' ' 46' ' ' THR . 0.1 OUTLIER 38.03 47.47 0.94 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.794 179.948 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.415 HD11 ' O ' ' A' ' 46' ' ' THR . 0.2 OUTLIER -150.38 94.71 2.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.063 -179.904 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.569 HG22 ' CD ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -113.13 -172.02 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.638 179.563 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -83.52 68.31 9.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.933 0.397 . . . . 0.0 111.331 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.569 ' CD ' HG22 ' A' ' 49' ' ' VAL . 12.6 mtpp -106.57 100.42 9.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.373 179.493 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.477 ' C ' ' O ' ' A' ' 51' ' ' LYS . 0.8 OUTLIER -31.24 99.29 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.14 -179.663 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 37.9 t -55.62 145.49 5.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.9 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 69.5 p -86.07 -133.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.493 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.8 -178.31 3.52 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.741 0.305 . . . . 0.0 111.134 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -115.03 -97.37 0.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.954 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.516 ' OG ' ' N ' ' A' ' 58' ' ' THR . 1.2 t -39.59 -92.85 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.046 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.516 ' N ' ' OG ' ' A' ' 57' ' ' SER . 0.0 OUTLIER 51.93 164.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.816 -179.927 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 61.7 m -153.01 150.19 28.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.951 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.87 128.8 43.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.821 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.527 ' O ' ' C ' ' A' ' 62' ' ' ALA . 61.0 t -131.56 64.47 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.738 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.527 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 21.15 103.43 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.992 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.86 ' N ' ' O ' ' A' ' 81' ' ' ALA . 15.1 tttt -54.18 -35.67 62.58 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.538 0.685 . . . . 0.0 109.335 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.537 ' O ' ' N ' ' A' ' 80' ' ' THR . 37.1 m -146.3 127.41 14.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.379 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.798 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -112.31 166.11 11.58 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.594 0.711 . . . . 0.0 112.576 -178.343 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.708 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -133.1 29.52 4.04 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 114.612 -1.176 . . . . 0.0 108.198 177.393 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.72 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.8 OUTLIER -16.13 125.31 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 112.426 -2.17 . . . . 0.0 111.6 -179.718 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.772 ' O ' HG21 ' A' ' 68' ' ' VAL . 2.7 m -128.57 41.92 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.328 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.65 ' C ' ' O ' ' A' ' 68' ' ' VAL . 55.0 m -9.75 118.35 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.665 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.673 ' CG2' ' CD1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -124.45 -171.1 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 121.52 0.676 . . . . 0.0 111.962 -178.765 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.466 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 42.6 mmm 34.3 -127.65 0.08 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.829 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -81.69 26.27 3.69 Favored Glycine 0 N--CA 1.44 -1.057 0 CA-C-N 115.498 -0.774 . . . . 0.0 112.566 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.598 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 104.69 43.02 1.74 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.468 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.612 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.0 m-85 -85.79 116.1 23.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.811 0.339 . . . . 0.0 111.011 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -99.65 104.5 16.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.121 0.486 . . . . 0.0 112.243 -179.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.828 ' CG2' ' CG2' ' A' ' 25' ' ' ILE . 12.6 m -92.32 14.64 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.361 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.755 178.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.798 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 29.18 39.94 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 105.508 -2.034 . . . . 0.0 105.508 -176.426 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.708 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 46.6 t30 -2.2 67.9 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.828 0 CA-C-N 113.245 -1.798 . . . . 0.0 108.53 -175.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.744 ' N ' ' O ' ' A' ' 77' ' ' GLU . 37.6 m170 -35.49 120.48 0.56 Allowed 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 113.264 -1.789 . . . . 0.0 113.877 -176.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.537 ' N ' ' O ' ' A' ' 64' ' ' SER . 3.9 p -111.16 -11.16 14.27 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 113.514 -1.675 . . . . 0.0 110.233 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.86 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -168.83 133.4 1.54 Allowed 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 1.3 m -119.74 137.16 54.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.919 0.39 . . . . 0.0 111.077 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.563 ' O ' ' CD2' ' A' ' 83' ' ' HIS . 0.6 OUTLIER -137.57 130.98 31.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.9 -179.855 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.51 ' O ' ' HB3' ' A' ' 85' ' ' SER . 0.0 OUTLIER -62.88 -175.45 0.09 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.932 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.51 ' HB3' ' O ' ' A' ' 84' ' ' CYS . 25.6 t 77.34 158.42 0.19 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.099 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' A' ' 85' ' ' SER . 4.9 p 64.4 114.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.169 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.8 136.83 42.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.709 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 46.19 55.53 7.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.346 -179.735 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.552 ' CG ' ' O ' ' A' ' 89' ' ' TYR . 0.9 OUTLIER -125.1 114.96 19.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.359 -179.484 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -132.12 -177.37 4.42 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.798 179.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.15 98.63 0.06 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.62 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.98 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.813 ' H3 ' ' HD2' ' A' ' 24' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.755 ' O7 ' ' C3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . 0.681 ' H4 ' ' C5 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . 0.681 ' C5 ' ' H4 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.637 ' H62' ' H1 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.536 ' O7 ' ' O3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . 0.637 ' H1 ' ' H62' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.509 ' CB ' ' HB ' ' A' ' 4' ' ' VAL . . . . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.977 0.418 . . . . 0.0 111.068 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -62.07 78.86 0.1 OUTLIER 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.785 2.323 . . . . 0.0 112.344 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.466 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 0.2 OUTLIER 74.81 46.68 0.13 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.113 179.847 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.509 ' HB ' ' CB ' ' A' ' 1' ' ' ALA . 48.7 t -134.56 68.23 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.017 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.435 ' O ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER 67.24 132.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.817 -179.841 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.435 ' O ' ' O ' ' A' ' 5' ' ' GLN . 6.9 m-20 -51.1 -172.86 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.914 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.407 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.1 OUTLIER -36.84 127.54 0.75 Allowed Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.964 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -59.45 -160.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.799 2.332 . . . . 0.0 112.037 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -105.18 135.3 46.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.196 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.503 ' HA ' ' HA2' ' A' ' 30' ' ' GLY . 3.0 t -41.37 131.18 2.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.314 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.753 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 1.7 t -155.48 -163.65 1.57 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.259 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.772 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 6.8 mp -98.32 138.69 35.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.015 0.436 . . . . 0.0 111.812 -179.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.707 ' O ' ' O ' ' A' ' 14' ' ' GLU . 20.2 mt-30 -115.14 52.28 0.87 Allowed 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 121.713 0.768 . . . . 0.0 110.79 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.707 ' O ' ' O ' ' A' ' 13' ' ' GLN . 8.3 tt0 7.7 126.35 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 113.327 -1.76 . . . . 0.0 112.336 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.667 ' HB2' HG23 ' A' ' 25' ' ' ILE . 1.4 t-20 -53.81 108.74 1.2 Allowed Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.249 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -74.12 20.71 0.4 Allowed 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.22 1.947 . . . . 0.0 111.727 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.593 ' CZ ' ' HG2' ' A' ' 71' ' ' MET . 34.8 t80 -128.34 -55.4 1.25 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.58 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.713 ' CD2' ' CG1' ' A' ' 70' ' ' VAL . 0.1 OUTLIER -71.69 -24.34 61.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.685 -179.772 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.642 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.2 m -40.03 92.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.182 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.607 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -124.29 138.89 31.68 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.592 -179.394 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.508 ' N ' ' OE1' ' A' ' 20' ' ' GLN . 83.4 Cg_exo -37.41 83.67 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.534 2.156 . . . . 0.0 112.08 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.607 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 127.37 -9.59 6.94 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.537 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.454 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -154.75 99.48 2.41 Favored Pre-proline 0 CA--C 1.512 -0.508 0 CA-C-O 122.011 0.91 . . . . 0.0 111.486 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.7 ' O ' ' O ' ' A' ' 25' ' ' ILE . 71.7 Cg_endo -103.63 66.67 0.03 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.57 0 C-N-CA 124.954 3.769 . . . . 0.0 112.608 -178.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.9 HG13 HG22 ' A' ' 68' ' ' VAL . 25.1 mm -37.59 -178.03 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.002 0 CA-C-N 115.322 -0.853 . . . . 0.0 113.284 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.777 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -153.78 -159.57 0.99 Allowed 'General case' 0 CA--C 1.498 -1.054 0 CA-C-O 122.726 1.25 . . . . 0.0 114.193 -175.343 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.598 ' O ' ' C ' ' A' ' 28' ' ' CYS . 0.8 OUTLIER 168.58 65.85 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 112.716 -2.038 . . . . 0.0 111.297 179.13 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.753 ' HA ' ' O ' ' A' ' 11' ' ' THR . 68.0 m -5.98 113.04 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.935 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.616 ' N ' ' O ' ' A' ' 11' ' ' THR . 3.3 tpp -141.29 108.9 5.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.84 0.352 . . . . 0.0 111.226 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.503 ' HA2' ' HA ' ' A' ' 10' ' ' CYS . . . -162.63 -130.12 1.09 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.356 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.41 ' O ' ' O ' ' A' ' 32' ' ' CYS . 0.0 OUTLIER -143.77 116.79 8.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.746 0.308 . . . . 0.0 110.965 -179.941 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.447 ' HB3' ' HB3' ' A' ' 84' ' ' CYS . 56.4 m -53.04 -169.57 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.001 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.468 ' O ' ' CB ' ' A' ' 34' ' ' SER . 0.7 OUTLIER -124.22 163.28 21.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.557 179.734 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.468 ' CB ' ' O ' ' A' ' 33' ' ' PHE . 1.3 t 82.25 53.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.711 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.412 ' N ' ' CD ' ' A' ' 35' ' ' ARG . 0.1 OUTLIER -53.25 126.9 22.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.951 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -124.82 174.26 8.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.885 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -120.36 155.54 56.16 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.938 0.399 . . . . 0.0 111.066 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -61.43 -175.84 0.16 Allowed 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.957 2.438 . . . . 0.0 112.514 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.422 ' O ' ' N ' ' A' ' 41' ' ' LEU . 0.8 OUTLIER -50.78 105.16 0.48 Allowed Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.851 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.503 ' O ' ' C ' ' A' ' 41' ' ' LEU . 24.1 Cg_exo -63.99 67.12 0.21 Allowed 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.918 2.412 . . . . 0.0 111.841 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.542 ' O ' ' CB ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -26.7 123.65 0.08 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.331 -179.588 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.542 ' CB ' ' O ' ' A' ' 41' ' ' LEU . 0.6 OUTLIER 155.79 -31.5 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.457 179.917 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.436 ' O ' ' O ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER 58.67 -80.83 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.152 179.62 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.484 ' HG3' ' SD ' ' A' ' 47' ' ' MET . 0.8 OUTLIER 59.57 134.31 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.774 -179.778 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.544 ' O ' ' O ' ' A' ' 46' ' ' THR . 0.1 OUTLIER -111.62 140.6 46.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.942 0.401 . . . . 0.0 111.515 -179.546 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.577 ' O ' ' HB3' ' A' ' 47' ' ' MET . 1.0 OUTLIER 27.83 105.66 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.095 179.33 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.577 ' HB3' ' O ' ' A' ' 46' ' ' THR . 20.3 ptm 155.07 161.52 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.651 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.516 ' CB ' ' O ' ' A' ' 47' ' ' MET . 0.2 OUTLIER 85.15 -174.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.944 179.994 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -127.57 -154.15 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.016 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 75.32 165.25 0.27 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.069 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.478 ' HE3' ' OG1' ' A' ' 54' ' ' THR . 0.0 OUTLIER -73.85 172.57 11.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.751 179.975 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.409 ' O ' ' O ' ' A' ' 53' ' ' VAL . 23.9 p30 -105.67 144.79 31.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.87 0.367 . . . . 0.0 111.146 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.5 ' O ' ' OG1' ' A' ' 54' ' ' THR . 10.5 t 57.96 149.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.34 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.716 ' O ' ' CB ' ' A' ' 55' ' ' SER . 2.8 m 177.74 135.65 0.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.37 -179.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.716 ' CB ' ' O ' ' A' ' 54' ' ' THR . 44.2 t 120.17 87.26 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.93 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.493 ' OE1' ' HA ' ' A' ' 85' ' ' SER . 0.0 OUTLIER -67.03 176.37 2.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.738 179.719 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.471 ' O ' ' O ' ' A' ' 58' ' ' THR . 14.4 p -74.33 -27.22 60.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.684 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.483 ' N ' ' OE1' ' A' ' 56' ' ' GLU . 0.5 OUTLIER 57.24 148.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.695 -179.879 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.479 ' SG ' ' O ' ' A' ' 85' ' ' SER . 28.0 p 175.78 121.13 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.958 0.408 . . . . 0.0 111.348 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.4 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 0.0 OUTLIER -96.89 57.07 1.49 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.619 179.684 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.565 ' O ' ' O ' ' A' ' 62' ' ' ALA . 32.5 t -76.51 49.92 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.975 0.416 . . . . 0.0 111.478 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.629 ' HB3' ' CG ' ' A' ' 79' ' ' HIS . . . 40.23 114.49 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.661 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.753 ' N ' ' O ' ' A' ' 81' ' ' ALA . 13.1 tttm -56.08 -37.1 68.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.52 0.676 . . . . 0.0 109.179 178.012 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.648 ' O ' ' N ' ' A' ' 80' ' ' THR . 70.7 m -143.71 117.51 9.31 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.379 179.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.712 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 2.5 p90 -106.35 162.4 13.71 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.836 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -132.95 27.82 4.22 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 107.613 -1.255 . . . . 0.0 107.613 176.67 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.67 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.2 OUTLIER -6.64 129.69 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 112.201 -2.272 . . . . 0.0 112.522 -179.424 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.9 HG22 HG13 ' A' ' 25' ' ' ILE . 4.9 m -138.76 53.31 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 114.585 -1.188 . . . . 0.0 110.302 179.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.654 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 17.7 m -24.91 118.22 0.05 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.182 0.515 . . . . 0.0 111.466 -178.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.713 ' CG1' ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -109.82 -171.21 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.283 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.593 ' HG2' ' CZ ' ' A' ' 17' ' ' PHE . 3.0 mtp 30.23 -149.68 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.51 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.448 ' H ' ' HB3' ' A' ' 71' ' ' MET . . . -46.76 -20.39 0.65 Allowed Glycine 0 N--CA 1.438 -1.181 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.822 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.573 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 152.78 32.41 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.665 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.654 ' O ' ' HA ' ' A' ' 69' ' ' THR . 9.1 m-30 -53.09 179.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.53 0.205 . . . . 0.0 110.81 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -155.0 103.4 2.39 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.883 0.373 . . . . 0.0 111.184 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.782 HG22 HG21 ' A' ' 25' ' ' ILE . 27.4 m -100.49 10.94 7.19 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.034 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.712 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 27.87 40.35 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 105.384 -2.08 . . . . 0.0 105.384 -177.092 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.836 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 48.0 t30 3.26 64.58 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 113.253 -1.794 . . . . 0.0 108.593 -174.022 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.772 ' O ' ' CD2' ' A' ' 12' ' ' LEU . 37.8 m170 -38.07 120.4 0.86 Allowed 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 112.779 -2.01 . . . . 0.0 113.154 -176.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.648 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.0 OUTLIER -110.19 -7.52 14.86 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 113.533 -1.667 . . . . 0.0 109.466 179.455 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.753 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -173.76 142.2 0.89 Allowed 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.253 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.651 ' SG ' ' CD1' ' A' ' 12' ' ' LEU . 3.2 m -115.93 163.13 16.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.305 0.574 . . . . 0.0 111.457 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.519 ' CG ' ' O ' ' A' ' 83' ' ' HIS . 6.1 p80 -165.58 107.27 0.77 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.128 179.034 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.467 ' O ' ' CB ' ' A' ' 85' ' ' SER . 0.9 OUTLIER -88.2 115.93 26.04 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.729 -179.72 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.514 ' O ' ' C ' ' A' ' 86' ' ' THR . 0.0 OUTLIER 163.44 151.25 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.173 179.98 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.514 ' C ' ' O ' ' A' ' 85' ' ' SER . 17.9 m -24.45 103.92 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.274 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.485 ' SG ' ' CG2' ' A' ' 61' ' ' VAL . 53.2 m -59.96 138.15 57.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.086 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.443 ' O ' ' HB2' ' A' ' 89' ' ' TYR . 45.8 t80 59.31 76.05 0.37 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.074 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.481 ' HB3' HG23 ' A' ' 86' ' ' THR . 49.9 t80 176.85 73.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.005 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -71.76 113.45 8.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.01 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.44 59.54 1.09 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.615 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.936 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.628 ' H3 ' ' HD2' ' A' ' 24' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.481 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . 0.672 ' O2 ' ' C5 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . 0.672 ' C5 ' ' O2 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . 0.458 ' H2 ' ' H61' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.408 ' H1 ' ' H1 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.472 ' C6 ' ' O5 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . 0.472 ' O5 ' ' C6 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.949 0.404 . . . . 0.0 110.97 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_exo -52.03 -66.44 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.696 2.264 . . . . 0.0 112.234 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.491 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 9.5 p-10 -61.42 143.77 55.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.79 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.0 m -142.57 123.81 11.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.292 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -129.19 133.57 47.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.792 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 172.62 34.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.114 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 55.75 58.67 9.88 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.182 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.67 71.22 4.04 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.755 2.303 . . . . 0.0 111.782 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 63.53 121.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.538 -179.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.591 ' CB ' ' O ' ' A' ' 31' ' ' CYS . 43.5 t -51.78 159.3 0.84 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.456 0.646 . . . . 0.0 111.524 -179.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.715 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 0.6 OUTLIER -179.28 -160.71 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.709 179.746 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.644 ' HA ' ' HA ' ' A' ' 28' ' ' CYS . 10.8 mp -90.2 128.37 36.35 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.164 0.507 . . . . 0.0 111.59 -179.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.619 ' O ' ' C ' ' A' ' 14' ' ' GLU . 5.0 mt-30 -96.52 46.96 1.06 Allowed 'General case' 0 CA--C 1.502 -0.867 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.775 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.786 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -0.29 117.1 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 113.775 -1.557 . . . . 0.0 110.797 -179.138 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.741 ' HB2' HG23 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -54.88 101.96 0.28 Allowed Pre-proline 0 C--N 1.31 -1.119 0 CA-C-N 114.552 -1.204 . . . . 0.0 112.413 -178.637 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.588 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 61.8 Cg_endo -73.67 7.41 2.34 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 122.091 1.861 . . . . 0.0 110.003 177.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.52 ' HB3' ' OD1' ' A' ' 15' ' ' ASN . 1.5 t80 -102.81 -60.7 1.5 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.191 -1.368 . . . . 0.0 110.102 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.641 ' CD1' HG13 ' A' ' 70' ' ' VAL . 3.2 m-85 -82.93 3.76 28.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.459 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.778 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 15.0 t -64.07 99.11 0.24 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.558 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.627 ' N ' ' O ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -102.26 170.33 6.5 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.991 179.046 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.539 ' HA ' ' O2 ' ' A' ' 186' ' ' GAL . 14.7 Cg_endo -57.45 73.12 0.04 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 122.454 2.103 . . . . 0.0 111.94 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 133.79 -9.61 4.89 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.359 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.653 ' HB1' ' C8 ' ' A' ' 178' ' ' NAG . . . -146.12 104.0 4.11 Favored Pre-proline 0 CA--C 1.509 -0.6 0 CA-C-O 121.81 0.815 . . . . 0.0 111.247 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.864 ' O ' ' O ' ' A' ' 25' ' ' ILE . 78.3 Cg_endo -97.06 25.39 0.25 Allowed 'Trans proline' 0 N--CA 1.449 -1.133 0 C-N-CA 124.46 3.44 . . . . 0.0 113.477 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.926 ' C ' ' HG ' ' A' ' 26' ' ' LEU . 10.7 mm 21.94 -175.03 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 114.932 -1.031 . . . . 0.0 112.843 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.926 ' HG ' ' C ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -158.76 -166.08 1.79 Allowed 'General case' 0 CA--C 1.498 -1.043 0 N-CA-C 115.656 1.725 . . . . 0.0 115.656 -174.743 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.558 ' CG ' ' O ' ' A' ' 27' ' ' GLN . 0.5 OUTLIER 166.54 66.99 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 111.561 -2.563 . . . . 0.0 110.75 179.642 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.77 ' HB2' ' HD1' ' A' ' 79' ' ' HIS . 0.1 OUTLIER -19.1 116.07 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.485 -0.779 . . . . 0.0 112.117 -179.089 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.55 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.2 OUTLIER -147.39 123.06 10.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.275 179.271 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.554 ' HA2' ' HA ' ' A' ' 10' ' ' CYS . . . 169.31 -136.51 4.08 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.974 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.591 ' O ' ' CB ' ' A' ' 10' ' ' CYS . 95.0 m -126.8 163.35 23.76 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.778 0.323 . . . . 0.0 111.075 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.511 ' C ' ' CD1' ' A' ' 33' ' ' PHE . 4.9 m -139.19 142.02 37.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.997 0.427 . . . . 0.0 111.476 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.518 ' CD1' ' N ' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -135.93 -172.84 3.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.383 179.239 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 6.7 t -76.6 -69.07 0.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.795 0.331 . . . . 0.0 110.604 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.516 ' CG ' ' N ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 54.08 168.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.384 179.594 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.516 ' N ' ' CG ' ' A' ' 35' ' ' ARG . . . 37.64 88.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.83 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.643 ' HB3' ' HD3' ' A' ' 38' ' ' PRO . 0.6 OUTLIER -118.13 -53.44 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.874 179.29 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.643 ' HD3' ' HB3' ' A' ' 37' ' ' TYR . 23.3 Cg_exo -63.96 176.74 2.26 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.505 2.137 . . . . 0.0 111.951 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.519 ' CB ' ' HD2' ' A' ' 40' ' ' PRO . 0.1 OUTLIER 176.82 169.06 0.42 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 120.91 0.386 . . . . 0.0 111.201 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.519 ' HD2' ' CB ' ' A' ' 39' ' ' THR . 17.6 Cg_endo -57.69 76.08 0.04 OUTLIER 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.92 2.413 . . . . 0.0 112.355 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.476 ' O ' ' HB2' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -172.13 60.65 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.578 179.888 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.476 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 0.9 OUTLIER 70.99 142.04 0.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.974 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.1 t -154.05 -123.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.638 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.548 ' O ' ' O ' ' A' ' 45' ' ' LYS . 2.2 mmtp 59.74 -177.97 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.052 0.453 . . . . 0.0 111.701 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.548 ' O ' ' O ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER 0.69 121.77 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.215 -0.902 . . . . 0.0 112.86 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.466 ' O ' ' CB ' ' A' ' 47' ' ' MET . 1.8 t -114.17 156.23 24.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.306 179.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.466 ' CB ' ' O ' ' A' ' 46' ' ' THR . 0.0 OUTLIER 161.78 97.88 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.708 -179.764 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.1 mp -146.71 143.52 28.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.932 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.5 t -56.03 118.82 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.973 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.487 ' CG ' ' O ' ' A' ' 50' ' ' GLN . 0.4 OUTLIER -88.78 36.32 0.8 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.648 179.751 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.492 ' HB3' ' ND2' ' A' ' 52' ' ' ASN . 12.0 tttt -86.05 -159.07 0.44 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.743 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.499 ' N ' ' ND2' ' A' ' 52' ' ' ASN . 0.0 OUTLIER 49.82 36.79 11.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.171 179.615 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.571 ' CG2' ' N ' ' A' ' 54' ' ' THR . 1.0 OUTLIER 36.29 -160.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.226 179.849 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.571 ' N ' ' CG2' ' A' ' 53' ' ' VAL . 5.4 t 175.72 37.14 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.274 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.438 ' OG ' ' O ' ' A' ' 55' ' ' SER . 8.3 p -133.86 87.81 2.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.89 0.376 . . . . 0.0 111.058 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.516 ' O ' ' OG ' ' A' ' 57' ' ' SER . 15.0 tt0 -84.59 -84.69 0.14 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.107 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.516 ' OG ' ' O ' ' A' ' 56' ' ' GLU . 1.2 m -173.23 101.9 0.12 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.868 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -133.82 156.45 48.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.923 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.495 ' O ' ' SG ' ' A' ' 87' ' ' CYS . 0.7 OUTLIER -179.37 126.4 0.09 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.156 179.91 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.442 ' C ' ' O ' ' A' ' 59' ' ' CYS . 0.1 OUTLIER -34.22 137.79 0.1 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.091 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.579 ' O ' ' CD2' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -150.15 71.47 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.52 179.779 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.579 ' HA ' ' O ' ' A' ' 81' ' ' ALA . . . 4.2 101.5 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.745 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.786 ' N ' ' O ' ' A' ' 81' ' ' ALA . 0.1 OUTLIER -54.4 -33.48 59.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.502 0.668 . . . . 0.0 109.749 178.291 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.48 ' O ' ' N ' ' A' ' 80' ' ' THR . 17.2 m -151.46 125.88 9.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.843 -1.072 . . . . 0.0 109.744 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.851 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.3 OUTLIER -106.33 163.94 12.43 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.278 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.771 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.9 OUTLIER -130.34 27.45 5.05 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 177.243 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.694 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 3.9 ptt-85 -12.39 99.81 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 112.515 -2.13 . . . . 0.0 111.623 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.66 ' CG2' ' CD1' ' A' ' 25' ' ' ILE . 8.2 m -97.61 45.9 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 CA-C-N 114.683 -1.144 . . . . 0.0 109.837 179.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.62 ' C ' ' O ' ' A' ' 68' ' ' VAL . 28.8 m -14.65 117.58 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.969 -178.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.641 HG13 ' CD1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -114.06 -162.43 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 121.768 0.794 . . . . 0.0 111.996 -179.604 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.635 ' O ' ' CD2' ' A' ' 74' ' ' PHE . 9.2 mtm -21.25 143.17 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 113.855 -1.52 . . . . 0.0 112.716 -178.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 43.62 20.86 0.15 Allowed Glycine 0 N--CA 1.444 -0.791 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.768 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.467 ' O ' ' O ' ' A' ' 74' ' ' PHE . . . 81.55 27.94 45.42 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.055 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.635 ' CD2' ' O ' ' A' ' 71' ' ' MET . 38.5 m-85 -50.45 -174.51 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.69 0.281 . . . . 0.0 110.337 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.8 mttt -167.66 104.76 0.51 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.029 0.442 . . . . 0.0 112.057 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.783 ' CG2' ' CG2' ' A' ' 25' ' ' ILE . 16.8 m -98.13 14.8 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.36 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.392 178.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.851 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.8 OUTLIER 30.77 38.31 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 105.288 -2.115 . . . . 0.0 105.288 -176.869 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.771 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 30.4 t30 -2.52 66.88 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.974 0 CA-C-N 112.776 -2.011 . . . . 0.0 108.858 -174.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.77 ' HD1' ' HB2' ' A' ' 28' ' ' CYS . 36.1 m170 -34.12 120.84 0.45 Allowed 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 113.349 -1.75 . . . . 0.0 112.405 -177.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.48 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.9 p -111.3 -14.25 13.82 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.368 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.786 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -165.08 138.86 4.8 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.1 OUTLIER -120.47 145.88 46.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.072 0.463 . . . . 0.0 111.5 -179.142 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.579 ' CD2' ' O ' ' A' ' 61' ' ' VAL . 0.6 OUTLIER -149.88 116.11 5.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.774 179.814 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 5.7 m -61.4 125.04 22.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.7 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.475 ' O ' ' SG ' ' A' ' 87' ' ' CYS . 8.0 m -162.3 -154.83 0.34 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.93 0.395 . . . . 0.0 111.081 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.461 ' C ' ' SG ' ' A' ' 87' ' ' CYS . 15.2 m -65.61 138.96 58.37 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.92 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.495 ' SG ' ' O ' ' A' ' 59' ' ' CYS . 0.1 OUTLIER -177.82 -179.61 0.8 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.726 179.891 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -45.06 123.92 4.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.989 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.525 ' O ' ' CD2' ' A' ' 90' ' ' HIS . 30.6 t80 -99.52 -67.76 0.84 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.54 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.525 ' CD2' ' O ' ' A' ' 89' ' ' TYR . 0.2 OUTLIER -177.04 17.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.112 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.431 ' O ' ' CB ' ' A' ' 92' ' ' SER . 0.0 OUTLIER -166.43 9.48 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.444 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.431 ' CB ' ' O ' ' A' ' 91' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.321 -0.847 . . . . 0.0 111.064 179.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.653 ' C8 ' ' HB1' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.518 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.46 ' H3 ' ' O7 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.591 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . 0.591 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . 0.539 ' O2 ' ' HA ' ' A' ' 21' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.825 0.345 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -63.15 167.44 12.54 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.917 2.411 . . . . 0.0 112.14 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -142.31 -40.02 0.35 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.917 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.528 ' O ' HG11 ' A' ' 4' ' ' VAL . 0.3 OUTLIER -125.79 138.86 53.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.907 179.952 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.511 ' HG2' HG12 ' A' ' 4' ' ' VAL . 10.2 mm100 69.92 -166.52 0.17 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.018 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.443 ' C ' ' O ' ' A' ' 5' ' ' GLN . 70.3 m-20 35.53 71.0 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.575 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -131.05 127.47 22.01 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.861 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.436 ' O ' ' SG ' ' A' ' 31' ' ' CYS . 60.6 Cg_endo -73.44 167.22 27.84 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 122.572 2.181 . . . . 0.0 112.135 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.435 ' HA ' ' HE1' ' A' ' 33' ' ' PHE . 1.8 tt0 -63.97 160.03 18.69 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.294 0.569 . . . . 0.0 111.144 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.52 ' HA ' ' HA2' ' A' ' 30' ' ' GLY . 1.0 OUTLIER -91.05 112.39 24.28 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.842 -179.954 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.573 ' O ' ' N ' ' A' ' 29' ' ' MET . 11.7 t -177.9 -177.42 0.63 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.246 0.546 . . . . 0.0 111.041 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.774 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 4.9 mp -64.04 131.28 47.12 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.716 -179.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.669 ' O ' ' O ' ' A' ' 14' ' ' GLU . 2.1 mt-30 -114.35 59.1 0.68 Allowed 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.253 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.669 ' O ' ' O ' ' A' ' 13' ' ' GLN . 31.5 tt0 4.56 125.26 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.327 -1.761 . . . . 0.0 112.231 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.788 ' HB2' HG23 ' A' ' 25' ' ' ILE . 9.1 t-20 -51.8 123.19 24.04 Favored Pre-proline 0 C--N 1.314 -0.937 0 CA-C-N 114.407 -1.269 . . . . 0.0 111.769 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -83.31 20.44 1.17 Allowed 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 122.692 2.261 . . . . 0.0 111.559 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.609 ' CD1' ' HB ' ' A' ' 70' ' ' VAL . 29.9 t80 -133.2 -52.55 0.9 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.449 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.735 ' CD1' ' CG1' ' A' ' 70' ' ' VAL . 0.2 OUTLIER -77.2 -10.78 59.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.964 -179.647 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -61.82 83.64 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.002 0.429 . . . . 0.0 110.682 -179.789 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.614 ' HB3' ' HD2' ' A' ' 21' ' ' PRO . 1.1 mt-30 -110.83 164.76 14.1 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.696 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.614 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 27.3 Cg_endo -61.62 61.33 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.574 2.183 . . . . 0.0 111.544 179.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 157.41 -15.31 0.32 Allowed Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.469 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.539 ' O ' ' O ' ' A' ' 18' ' ' PHE . . . -148.71 104.86 3.44 Favored Pre-proline 0 CA--C 1.514 -0.415 0 CA-C-O 121.905 0.86 . . . . 0.0 111.654 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.652 ' O ' ' O ' ' A' ' 25' ' ' ILE . 92.3 Cg_endo -105.37 67.39 0.02 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.455 0 C-N-CA 124.756 3.637 . . . . 0.0 113.379 -178.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.84 ' CG2' ' H ' ' A' ' 26' ' ' LEU . 29.8 mm -41.87 -173.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.032 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.753 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.84 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -151.51 -157.72 0.84 Allowed 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -175.192 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.529 ' CG ' ' O ' ' A' ' 27' ' ' GLN . 3.8 tt0 169.44 66.12 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 112.895 -1.957 . . . . 0.0 111.321 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.694 ' CB ' ' HD1' ' A' ' 79' ' ' HIS . 17.0 t -23.78 99.35 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.7 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.573 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.3 OUTLIER -137.14 145.45 43.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.061 -179.654 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.52 ' HA2' ' HA ' ' A' ' 10' ' ' CYS . . . 162.47 -127.08 1.65 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.569 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.436 ' SG ' ' O ' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -154.57 133.49 12.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.89 0.376 . . . . 0.0 110.732 -179.84 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.526 ' O ' ' HB3' ' A' ' 33' ' ' PHE . 98.2 m -71.79 108.83 5.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.572 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.556 ' CD1' ' C ' ' A' ' 33' ' ' PHE . 0.0 OUTLIER 173.98 9.11 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.324 179.504 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.425 ' O ' ' O ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -45.71 124.4 5.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.84 0.352 . . . . 0.0 110.78 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.439 ' O ' ' O ' ' A' ' 36' ' ' ALA . 0.5 OUTLIER 58.17 151.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.711 -179.666 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.439 ' O ' ' O ' ' A' ' 35' ' ' ARG . . . 40.35 96.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.18 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.6 p90 -84.29 121.48 75.31 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 120.93 0.395 . . . . 0.0 110.638 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.487 ' O ' ' HD3' ' A' ' 40' ' ' PRO . 74.7 Cg_exo -48.26 -178.42 0.01 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.79 2.326 . . . . 0.0 112.126 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.5 ' HB ' HD12 ' A' ' 41' ' ' LEU . 18.4 p -104.66 80.63 0.48 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.807 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.487 ' HD3' ' O ' ' A' ' 38' ' ' PRO . 50.3 Cg_exo -40.46 -73.44 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.859 2.372 . . . . 0.0 112.409 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.5 HD12 ' HB ' ' A' ' 39' ' ' THR . 0.1 OUTLIER 32.21 54.32 0.32 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.059 -179.848 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.563 ' O ' ' CB ' ' A' ' 43' ' ' SER . 0.4 OUTLIER 73.0 127.86 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.702 -179.826 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.563 ' CB ' ' O ' ' A' ' 42' ' ' ARG . 3.4 t 87.98 135.75 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.653 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.2 mtpt -102.49 47.59 0.89 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.363 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.06 152.71 3.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.642 179.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.01 150.99 2.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.72 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -84.3 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.176 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.439 ' H ' ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -58.2 -179.2 0.05 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.834 0.35 . . . . 0.0 110.861 -179.825 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.5 p -93.2 130.8 41.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.075 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.447 ' O ' ' C ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER 177.9 48.16 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.652 -179.78 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.447 ' C ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER 31.01 94.78 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.32 -179.908 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.436 ' C ' ' O ' ' A' ' 51' ' ' LYS . 5.5 p30 -33.35 133.62 0.15 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.948 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.431 HG21 ' N ' ' A' ' 54' ' ' THR . 12.1 p -139.09 155.28 26.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.242 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.431 ' N ' HG21 ' A' ' 53' ' ' VAL . 0.2 OUTLIER 48.48 47.09 20.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.949 179.797 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.0 m 46.85 -93.99 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.521 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.424 ' O ' ' CB ' ' A' ' 57' ' ' SER . 0.0 OUTLIER -91.09 -94.96 0.12 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.442 -179.285 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.479 ' OG ' ' N ' ' A' ' 58' ' ' THR . 2.0 p 77.17 -149.11 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.564 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.546 ' O ' ' CB ' ' A' ' 59' ' ' CYS . 0.2 OUTLIER 58.07 172.26 0.05 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.856 -179.885 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.546 ' CB ' ' O ' ' A' ' 58' ' ' THR . 0.7 OUTLIER 156.07 133.94 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.904 179.836 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 90.3 m -73.25 65.5 0.84 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.715 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.572 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -91.87 73.63 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.877 0.37 . . . . 0.0 111.358 -179.832 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.651 ' HB3' ' CG ' ' A' ' 79' ' ' HIS . . . 11.67 116.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.345 -0.843 . . . . 0.0 113.096 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.682 ' N ' ' O ' ' A' ' 81' ' ' ALA . 6.0 ttmm -54.53 -38.56 66.7 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 177.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.516 ' N ' ' HB3' ' A' ' 81' ' ' ALA . 2.9 m -134.38 166.38 22.97 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.364 -1.289 . . . . 0.0 108.815 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.756 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 0.5 OUTLIER -151.4 159.28 44.32 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.165 -0.614 . . . . 0.0 112.491 -179.285 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.955 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -128.65 28.07 5.44 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 122.554 1.169 . . . . 0.0 107.903 176.798 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.649 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.5 OUTLIER -4.95 130.67 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 112.174 -2.285 . . . . 0.0 113.09 -179.496 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.998 ' O ' HG21 ' A' ' 68' ' ' VAL . 1.6 m -144.57 46.79 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.243 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.69 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 16.9 m -12.05 122.33 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.75 -1.113 . . . . 0.0 111.649 -179.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.735 ' CG1' ' CD1' ' A' ' 18' ' ' PHE . 3.7 m -119.03 -169.1 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.946 0.879 . . . . 0.0 112.759 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.62 ' SD ' ' CZ ' ' A' ' 74' ' ' PHE . 0.4 OUTLIER 21.34 -120.57 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.02 -1.445 . . . . 0.0 112.529 179.917 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.433 ' H ' ' CG ' ' A' ' 71' ' ' MET . . . -70.75 31.66 0.49 Allowed Glycine 0 CA--C 1.518 0.231 0 CA-C-N 115.986 -0.552 . . . . 0.0 113.504 -178.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.541 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 90.85 22.1 34.34 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.685 -0.769 . . . . 0.0 111.756 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.69 ' O ' ' HA ' ' A' ' 69' ' ' THR . 0.6 OUTLIER -45.7 -178.95 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.091 0.472 . . . . 0.0 111.374 -179.887 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.56 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -154.66 82.33 1.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.369 179.543 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.817 ' CG2' ' CG2' ' A' ' 25' ' ' ILE . 27.2 m -78.38 12.25 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.493 -1.241 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.229 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.756 ' O ' ' CB ' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 24.07 44.58 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 -178.364 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.955 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 31.3 t-20 6.36 63.36 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 -174.367 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.774 ' O ' ' CD2' ' A' ' 12' ' ' LEU . 32.2 m170 -37.98 108.79 0.09 Allowed 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.433 -176.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.552 ' CG2' ' O ' ' A' ' 78' ' ' ASN . 4.7 p -104.48 -5.14 21.89 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.012 -1.449 . . . . 0.0 110.702 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.682 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -162.06 144.32 11.33 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 179.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.591 ' SG ' ' CD1' ' A' ' 12' ' ' LEU . 84.5 m -121.13 157.56 29.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.062 0.458 . . . . 0.0 111.718 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.589 ' CD2' ' HA ' ' A' ' 63' ' ' LYS . 0.2 OUTLIER 176.39 118.12 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.377 179.628 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 34.5 m -51.57 131.48 29.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.413 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.498 ' O ' ' C ' ' A' ' 86' ' ' THR . 0.2 OUTLIER -171.77 145.93 2.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.507 179.738 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.498 ' C ' ' O ' ' A' ' 85' ' ' SER . 0.8 OUTLIER -29.16 142.99 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.009 -179.711 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.494 ' O ' ' C ' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -95.54 130.13 42.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.16 -179.688 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.593 ' O ' ' C ' ' A' ' 89' ' ' TYR . 0.1 OUTLIER -29.0 115.18 0.09 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.867 179.724 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.593 ' C ' ' O ' ' A' ' 88' ' ' TYR . 2.6 m-85 -12.51 -73.83 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.538 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.592 ' CD2' ' O ' ' A' ' 89' ' ' TYR . 0.7 OUTLIER 153.36 140.64 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.731 179.819 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -47.47 169.96 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.875 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.837 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.542 ' C6 ' ' H1 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.763 ' O7 ' ' C3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.653 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . 0.653 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.445 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.763 0.316 . . . . 0.0 110.954 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 1' ' ' ALA . 6.3 Cg_exo -77.26 -155.25 0.05 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 123.008 2.472 . . . . 0.0 112.304 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.28 111.67 3.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.868 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.0 m -90.86 168.12 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.132 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -148.83 177.52 9.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.762 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.561 ' OD1' ' N ' ' A' ' 6' ' ' ASP . 3.1 p-10 -129.66 -176.18 3.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.078 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.505 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.1 OUTLIER -25.53 103.13 0.12 Allowed Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.402 -179.925 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.44 ' O ' ' C ' ' A' ' 9' ' ' GLU . 72.6 Cg_endo -78.39 143.78 19.82 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.732 2.288 . . . . 0.0 112.104 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.526 ' O ' ' CG2' ' A' ' 11' ' ' THR . 0.0 OUTLIER -34.76 115.93 0.3 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.882 0.373 . . . . 0.0 110.626 179.876 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.458 ' O ' HG23 ' A' ' 11' ' ' THR . 7.2 t -49.94 136.87 17.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.204 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.846 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -161.96 -137.01 0.03 OUTLIER 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.973 179.325 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.846 ' N ' ' OG1' ' A' ' 11' ' ' THR . 0.1 OUTLIER -111.5 129.53 56.02 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.156 179.226 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.611 ' O ' ' C ' ' A' ' 14' ' ' GLU . 1.2 mt-30 -103.01 48.15 0.86 Allowed 'General case' 0 CA--C 1.502 -0.899 0 CA-C-O 121.713 0.768 . . . . 0.0 110.846 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.611 ' C ' ' O ' ' A' ' 13' ' ' GLN . 39.4 tt0 -7.12 120.69 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.52 -1.673 . . . . 0.0 110.619 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.752 ' HB2' HG23 ' A' ' 25' ' ' ILE . 0.4 OUTLIER -54.46 98.95 0.19 Allowed Pre-proline 0 C--N 1.306 -1.318 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.98 -178.904 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.593 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 2.8 Cg_exo -73.84 6.0 3.12 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.464 2.109 . . . . 0.0 109.224 177.809 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.523 ' H ' ' C ' ' A' ' 15' ' ' ASN . 1.0 OUTLIER -101.27 -54.3 2.81 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 113.671 -1.604 . . . . 0.0 110.398 -179.673 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.747 ' CD2' HG23 ' A' ' 70' ' ' VAL . 0.4 OUTLIER -86.97 -21.77 25.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.879 -179.714 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.677 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 28.2 t -37.9 107.53 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.758 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.407 ' HG3' ' HB2' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -115.0 171.29 4.59 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.945 -179.692 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -65.63 70.29 0.34 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.855 2.37 . . . . 0.0 111.601 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 135.29 -5.79 4.24 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.197 -179.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.565 ' HB3' ' C8 ' ' A' ' 178' ' ' NAG . . . -151.37 102.72 2.93 Favored Pre-proline 0 CA--C 1.513 -0.459 0 CA-C-O 122.037 0.922 . . . . 0.0 111.526 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.677 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 88.6 Cg_endo -103.0 80.02 0.03 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.529 0 C-N-CA 124.788 3.659 . . . . 0.0 113.131 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.828 HG21 HG22 ' A' ' 76' ' ' VAL . 15.1 mm -40.8 -177.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.97 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.634 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.792 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.04 -160.82 1.2 Allowed 'General case' 0 CA--C 1.498 -1.057 0 CA-C-O 122.681 1.229 . . . . 0.0 114.237 -175.624 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.513 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 4.7 tt0 159.98 62.21 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 112.348 -2.206 . . . . 0.0 110.324 179.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.725 ' SG ' ' HB3' ' A' ' 79' ' ' HIS . 75.9 m -23.35 118.69 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.275 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.602 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -150.1 130.07 13.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.003 0.43 . . . . 0.0 111.389 179.767 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 170.42 -112.88 0.48 Allowed Glycine 0 N--CA 1.452 -0.265 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.099 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -162.14 153.84 18.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.683 0.278 . . . . 0.0 110.589 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.5 ' HB2' ' HB3' ' A' ' 84' ' ' CYS . 6.1 t -114.55 80.64 1.43 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.874 0.369 . . . . 0.0 111.248 -179.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -117.07 -5.78 11.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.532 179.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 56.8 m -103.07 -164.9 1.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.705 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.526 ' NH2' ' O ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -176.97 44.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.252 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.41 ' C ' ' O ' ' A' ' 35' ' ' ARG . . . -38.23 92.66 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.68 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.544 ' CB ' ' HD3' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -89.6 -59.73 0.24 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.204 -179.633 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.544 ' HD3' ' CB ' ' A' ' 37' ' ' TYR . 83.1 Cg_endo -89.75 174.31 3.4 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.036 2.491 . . . . 0.0 112.875 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.588 ' OG1' ' HD2' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -121.72 163.08 33.21 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.312 179.687 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.588 ' HD2' ' OG1' ' A' ' 39' ' ' THR . 60.2 Cg_endo -82.93 53.3 4.33 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.498 2.132 . . . . 0.0 112.276 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.519 ' O ' ' HB3' ' A' ' 42' ' ' ARG . 5.2 mt -149.05 125.43 10.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.624 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.519 ' HB3' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER 70.34 -83.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.941 -179.736 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.89 43.81 0.61 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.945 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.78 93.44 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.958 0.408 . . . . 0.0 110.514 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.447 ' O ' HG21 ' A' ' 46' ' ' THR . 0.0 OUTLIER -169.35 151.48 4.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.725 -179.708 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.447 HG21 ' O ' ' A' ' 45' ' ' LYS . 61.5 p -143.8 82.78 1.73 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.9 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.02 5.3 7.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.072 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.526 ' O ' ' NH2' ' A' ' 35' ' ' ARG . 0.1 OUTLIER -81.32 76.26 8.26 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.94 0.4 . . . . 0.0 110.746 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.523 ' CG2' ' HG2' ' A' ' 50' ' ' GLN . 4.4 m -91.0 -151.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.192 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.523 ' HG2' ' CG2' ' A' ' 49' ' ' VAL . 0.8 OUTLIER 37.68 84.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.521 ' O ' ' CG ' ' A' ' 51' ' ' LYS . 37.1 tttt 166.5 53.96 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.573 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -175.26 118.39 0.17 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.115 -179.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 9.9 p -122.01 154.79 26.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.052 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.6 p -107.25 100.74 10.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.7 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.06 11.58 16.46 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.63 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 54.19 59.57 4.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.727 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.463 ' C ' ' OG1' ' A' ' 58' ' ' THR . 0.5 OUTLIER -139.31 -163.95 1.58 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.725 -179.841 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.463 ' OG1' ' C ' ' A' ' 57' ' ' SER . 0.0 OUTLIER 63.44 164.35 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.989 179.935 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 17.3 p -162.4 142.0 9.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 65.6 m -81.66 102.31 10.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.7 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.515 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.1 OUTLIER -116.82 49.72 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 121.154 0.502 . . . . 0.0 111.288 -179.961 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.608 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 44.15 112.85 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.528 179.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.661 ' HB3' ' CB ' ' A' ' 81' ' ' ALA . 19.5 ttmt -56.12 -36.69 68.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.589 0.709 . . . . 0.0 109.243 178.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.552 ' O ' ' N ' ' A' ' 80' ' ' THR . 18.5 m -147.09 135.17 21.5 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.752 -1.113 . . . . 0.0 108.62 179.249 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.691 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.3 OUTLIER -119.29 155.27 32.11 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.235 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.92 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -128.91 26.71 5.51 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 176.289 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.696 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.5 OUTLIER -4.91 127.62 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 112.58 -2.1 . . . . 0.0 111.769 -179.529 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.843 ' O ' HG21 ' A' ' 70' ' ' VAL . 2.4 m -128.09 42.43 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.837 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.662 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 73.4 m -19.04 118.2 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.598 -179.032 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.843 HG21 ' O ' ' A' ' 68' ' ' VAL . 0.1 OUTLIER -129.87 -167.5 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.732 179.741 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.59 ' HG3' ' CD2' ' A' ' 74' ' ' PHE . 0.2 OUTLIER 37.04 -137.94 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.342 -179.701 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -80.35 30.63 2.44 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.308 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.66 47.09 0.99 Allowed Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.336 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.662 ' O ' ' HA ' ' A' ' 69' ' ' THR . 9.2 m-30 -90.47 113.42 25.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.844 0.354 . . . . 0.0 110.904 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.572 ' HB3' ' OE1' ' A' ' 77' ' ' GLU . 1.9 mmmm -99.44 107.61 19.87 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.129 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.828 HG22 HG21 ' A' ' 25' ' ' ILE . 11.8 m -97.24 15.84 2.98 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.499 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.43 178.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.696 ' HA ' ' HB3' ' A' ' 67' ' ' ARG . 0.0 OUTLIER 25.03 41.97 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.132 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -177.344 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.92 ' HB3' ' CA ' ' A' ' 66' ' ' ASN . 10.9 t-20 9.19 65.58 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.998 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 -175.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.797 ' O ' ' CD2' ' A' ' 12' ' ' LEU . 25.6 m170 -42.27 89.73 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 122.455 1.122 . . . . 0.0 111.977 -175.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.732 HG21 ' OD1' ' A' ' 78' ' ' ASN . 4.2 p -79.88 -1.33 38.68 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 113.712 -1.585 . . . . 0.0 110.408 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.661 ' CB ' ' HB3' ' A' ' 63' ' ' LYS . . . -177.17 147.05 0.53 Allowed 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 2.7 m -116.15 164.94 13.74 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.875 0.369 . . . . 0.0 111.178 -179.279 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.557 ' CD2' ' HA ' ' A' ' 63' ' ' LYS . 1.9 p80 178.85 122.05 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.941 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.5 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 28.7 p -76.26 123.86 26.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.993 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.4 t -147.71 135.91 21.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.17 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.413 ' HA ' ' HA ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -54.66 113.35 1.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.781 179.889 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.419 ' O ' ' C ' ' A' ' 88' ' ' TYR . 5.1 p -114.26 138.71 50.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.808 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.631 ' N ' ' CD1' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -34.03 146.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.043 179.947 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -157.28 76.25 0.83 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.978 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 29.0 m80 -147.75 171.14 16.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.476 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.412 ' C ' ' OG ' ' A' ' 92' ' ' SER . 2.5 mmtp -116.02 -160.9 0.77 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.859 0.361 . . . . 0.0 111.076 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.412 ' OG ' ' C ' ' A' ' 91' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.2 -0.905 . . . . 0.0 111.002 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.568 ' O4 ' ' O7 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.568 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.598 ' O7 ' ' O3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.559 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.877 0.37 . . . . 0.0 111.003 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.559 ' HD2' ' N ' ' A' ' 1' ' ' ALA . 18.6 Cg_endo -60.2 77.13 0.06 OUTLIER 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.711 2.274 . . . . 0.0 111.945 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.425 ' N ' ' O ' ' A' ' 1' ' ' ALA . 0.4 OUTLIER -123.96 120.46 32.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.096 -179.755 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.1 m -131.8 165.94 30.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.04 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.494 ' O ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -161.96 120.4 2.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.804 0.335 . . . . 0.0 111.574 -179.754 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.587 ' O ' ' C ' ' A' ' 7' ' ' CYS . 1.1 m-20 35.43 -161.03 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.352 179.298 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.587 ' C ' ' O ' ' A' ' 6' ' ' ASP . 4.9 t -3.8 89.33 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.296 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.165 -179.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.605 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 93.3 Cg_endo -81.96 39.99 0.92 Allowed 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.909 2.406 . . . . 0.0 111.935 179.516 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.605 ' CB ' ' O ' ' A' ' 8' ' ' PRO . 0.0 OUTLIER 95.19 141.91 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.927 -179.723 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.468 ' HA ' ' HA2' ' A' ' 30' ' ' GLY . 0.0 OUTLIER -38.78 137.54 0.63 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.96 180.0 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.557 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 2.7 t 174.98 -165.57 0.03 OUTLIER 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 120.953 0.406 . . . . 0.0 110.611 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.704 ' CD2' ' HB2' ' A' ' 79' ' ' HIS . 6.5 mp -90.12 136.9 32.77 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.042 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.609 ' O ' ' O ' ' A' ' 14' ' ' GLU . 4.9 mt-30 -108.98 55.11 0.64 Allowed 'General case' 0 CA--C 1.503 -0.863 0 CA-C-O 121.739 0.781 . . . . 0.0 110.55 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.609 ' O ' ' O ' ' A' ' 13' ' ' GLN . 26.8 tt0 -1.13 122.12 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 113.419 -1.719 . . . . 0.0 111.203 -179.271 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.803 ' HB2' HG23 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -50.49 98.5 0.18 Allowed Pre-proline 0 C--N 1.304 -1.371 0 CA-C-N 114.154 -1.385 . . . . 0.0 111.904 -179.201 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.541 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 7.0 Cg_exo -71.8 20.45 0.27 Allowed 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 122.373 2.049 . . . . 0.0 109.592 177.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.627 ' H ' ' C ' ' A' ' 15' ' ' ASN . 1.5 t80 -125.1 -55.8 1.57 Allowed 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.157 -178.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.633 ' HD2' HG22 ' A' ' 25' ' ' ILE . 2.0 m-30 -83.12 -6.17 59.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.173 -179.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.645 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 6.1 t -60.45 83.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.769 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.79 ' O ' ' N ' ' A' ' 22' ' ' GLY . 9.0 mm100 -97.66 145.03 29.01 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.802 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -44.12 69.96 0.01 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.736 2.29 . . . . 0.0 111.459 179.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.79 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 153.06 -20.2 0.75 Allowed Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.126 -179.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.543 ' CB ' ' H81' ' A' ' 178' ' ' NAG . . . -150.44 108.64 3.15 Favored Pre-proline 0 CA--C 1.515 -0.382 0 CA-C-O 121.892 0.853 . . . . 0.0 111.519 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.645 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 62.9 Cg_endo -101.74 73.06 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.35 0 C-N-CA 124.705 3.603 . . . . 0.0 113.22 -178.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.863 HG21 ' H ' ' A' ' 26' ' ' LEU . 6.9 mm -40.63 -176.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 N-CA-C 113.483 0.919 . . . . 0.0 113.483 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.863 ' H ' HG21 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -150.21 -162.48 1.56 Allowed 'General case' 0 CA--C 1.502 -0.888 0 CA-C-O 122.635 1.207 . . . . 0.0 114.175 -175.692 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.531 ' O ' ' C ' ' A' ' 28' ' ' CYS . 10.6 tt0 164.2 77.67 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 112.661 -2.063 . . . . 0.0 110.903 179.493 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.592 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER -19.21 114.65 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.28 -179.568 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.544 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.8 mtp -154.1 109.25 3.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.799 0.333 . . . . 0.0 111.204 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.468 ' HA2' ' HA ' ' A' ' 10' ' ' CYS . . . -172.53 -146.67 5.48 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.634 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.511 ' N ' ' SG ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -148.51 115.26 6.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.765 0.316 . . . . 0.0 110.862 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -52.66 122.98 10.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.89 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -85.15 164.34 18.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.997 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -113.8 -152.19 0.5 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.778 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.74 35.86 4.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.982 0.42 . . . . 0.0 110.881 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.81 177.47 2.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.069 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.415 ' O ' ' C ' ' A' ' 38' ' ' PRO . 2.1 p90 -153.48 153.81 29.66 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.811 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.415 ' C ' ' O ' ' A' ' 37' ' ' TYR . 51.4 Cg_exo -32.08 123.72 0.1 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 123.021 2.48 . . . . 0.0 112.056 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.496 ' O ' ' CG2' ' A' ' 39' ' ' THR . 23.0 m -123.08 61.12 17.21 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.378 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.531 ' O ' ' N ' ' A' ' 42' ' ' ARG . 61.2 Cg_endo -72.81 -35.65 5.46 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.712 2.274 . . . . 0.0 112.102 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.532 ' O ' ' HB2' ' A' ' 42' ' ' ARG . 4.8 mt 34.13 -89.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.468 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.532 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 1.2 mtp85 71.02 31.6 2.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.753 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.7 p -137.67 -93.26 0.21 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.098 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -140.21 121.76 15.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.672 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 5.9 mmtp -51.38 -177.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.621 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.446 ' O ' ' C ' ' A' ' 47' ' ' MET . 0.9 OUTLIER -123.36 -44.46 2.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.417 -179.645 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.555 ' CG ' ' O ' ' A' ' 47' ' ' MET . 0.0 OUTLIER 34.91 69.61 0.16 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.855 0.359 . . . . 0.0 110.539 -179.407 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.7 -169.47 1.62 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.958 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -85.74 165.06 2.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.874 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 57.38 22.81 8.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.617 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -155.57 76.18 0.94 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.956 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.474 ' ND2' ' HE1' ' A' ' 47' ' ' MET . 1.2 t-20 -162.09 25.97 0.11 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.739 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.77 155.63 30.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.27 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.23 -177.97 3.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.891 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.9 m -121.09 87.56 2.78 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.852 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.442 ' O ' ' CB ' ' A' ' 57' ' ' SER . 0.3 OUTLIER -121.58 -177.8 3.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.261 -179.976 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.442 ' CB ' ' O ' ' A' ' 56' ' ' GLU . 0.3 OUTLIER 79.94 -1.14 2.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.542 -179.557 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.486 ' HB ' ' SG ' ' A' ' 84' ' ' CYS . 0.6 OUTLIER -67.2 140.88 57.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.647 179.733 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.543 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 0.7 OUTLIER -145.54 137.1 25.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.172 -179.852 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.69 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -119.82 54.95 0.99 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.391 -179.809 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.561 ' O ' ' C ' ' A' ' 62' ' ' ALA . 6.0 t -56.17 85.01 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.66 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.561 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 7.65 111.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.589 -179.747 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.762 ' N ' ' O ' ' A' ' 81' ' ' ALA . 6.2 tptp -55.2 -39.23 69.39 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.73 0.776 . . . . 0.0 109.377 178.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.512 ' O ' ' N ' ' A' ' 80' ' ' THR . 0.7 OUTLIER -147.41 133.12 18.89 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.353 179.56 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.64 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 1.6 p90 -115.91 169.54 9.16 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 121.879 0.847 . . . . 0.0 112.527 -178.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.764 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -131.45 27.5 4.72 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 113.888 -1.506 . . . . 0.0 107.133 176.104 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.585 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -4.99 92.6 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.15 -2.296 . . . . 0.0 111.319 -179.736 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.77 HG13 HG13 ' A' ' 25' ' ' ILE . 30.1 t -94.14 71.68 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.401 0 CA-C-N 113.213 -1.812 . . . . 0.0 111.089 -179.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.676 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 99.6 m -54.09 117.72 3.46 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.174 0.511 . . . . 0.0 110.441 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.632 HG23 ' CG ' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -128.13 -166.64 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.849 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.683 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 1.5 mmm 35.89 -135.42 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.53 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -82.16 30.33 3.01 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.357 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 106.33 53.9 0.72 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.545 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.683 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 4.0 m-85 -100.42 112.88 25.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.747 0.308 . . . . 0.0 111.047 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.482 ' O ' ' OE2' ' A' ' 77' ' ' GLU . 19.0 mtpt -99.94 108.98 21.35 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.287 0.565 . . . . 0.0 111.433 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.854 HG22 HG21 ' A' ' 25' ' ' ILE . 15.8 m -94.76 18.0 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.486 -1.483 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.667 179.163 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.841 ' O ' ' HD2' ' A' ' 79' ' ' HIS . 0.4 OUTLIER 29.77 39.12 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 -176.099 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.764 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 38.3 t30 -8.02 70.08 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 113.332 -1.758 . . . . 0.0 108.582 -174.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.841 ' HD2' ' O ' ' A' ' 77' ' ' GLU . 42.5 m170 -40.5 118.04 0.89 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 112.958 -1.928 . . . . 0.0 114.246 -176.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.512 ' N ' ' O ' ' A' ' 64' ' ' SER . 2.3 p -103.46 -7.78 20.66 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 113.481 -1.69 . . . . 0.0 109.888 178.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.762 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -174.38 140.46 0.65 Allowed 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.543 179.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.532 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 1.3 m -128.54 121.56 29.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.714 0.292 . . . . 0.0 110.268 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.69 ' O ' ' HA ' ' A' ' 60' ' ' CYS . 0.6 OUTLIER -109.85 105.27 14.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.088 0.47 . . . . 0.0 111.677 -179.359 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.543 ' HA ' ' O ' ' A' ' 59' ' ' CYS . 4.6 t -77.16 153.74 33.86 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.729 179.392 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.518 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 0.7 OUTLIER 84.32 40.32 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.931 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.5 ' O ' ' CG2' ' A' ' 86' ' ' THR . 1.3 t -115.24 38.64 3.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.858 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 57' ' ' SER . 94.5 m -137.93 54.7 1.79 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.057 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 20.2 m-30 51.06 -175.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.194 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 61.56 97.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.245 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -129.87 -15.89 3.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.114 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.5 tttt -95.75 121.37 37.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.769 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.812 179.802 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.709 ' C6 ' ' H1 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.76 ' O7 ' ' C3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . 0.832 ' H62' ' H5 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . 0.597 ' C5 ' ' H2 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . 0.832 ' H5 ' ' H62' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.503 ' O3 ' ' O5 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.564 ' O7 ' ' O2 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . 0.455 ' O5 ' ' O6 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . 0.503 ' O5 ' ' O3 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.557 ' N ' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 120.972 0.415 . . . . 0.0 111.035 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.557 ' CD ' ' N ' ' A' ' 1' ' ' ALA . 32.3 Cg_exo -57.96 149.7 68.81 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.824 2.35 . . . . 0.0 112.243 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.466 ' O ' HG11 ' A' ' 4' ' ' VAL . 0.5 OUTLIER -77.33 149.43 35.29 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.901 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.466 HG11 ' O ' ' A' ' 3' ' ' ASP . 8.9 p 37.81 29.0 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.216 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.488 ' O ' ' HB2' ' A' ' 6' ' ' ASP . 1.7 tp-100 -132.76 78.82 1.81 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.764 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.488 ' HB2' ' O ' ' A' ' 5' ' ' GLN . 2.8 m-20 80.64 -173.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.86 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -96.12 130.22 31.76 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.991 -179.819 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 7' ' ' CYS . 14.9 Cg_exo -68.22 88.55 0.39 Allowed 'Trans proline' 0 C--O 1.23 0.125 0 C-N-CA 122.843 2.362 . . . . 0.0 112.125 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.514 ' O ' ' C ' ' A' ' 10' ' ' CYS . 0.2 OUTLIER -45.89 106.03 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.977 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.514 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER 23.15 87.81 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.087 179.921 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.752 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 2.9 t -150.87 -166.77 2.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.263 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.654 ' CD2' ' HB2' ' A' ' 79' ' ' HIS . 4.2 mp -100.86 138.87 37.34 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.085 0.469 . . . . 0.0 111.189 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.646 ' CG ' ' HB2' ' A' ' 29' ' ' MET . 2.4 mt-30 -108.92 58.67 0.6 Allowed 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.209 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.624 ' HG3' ' O ' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -4.12 122.28 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 114.03 -1.441 . . . . 0.0 111.469 -179.429 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.795 ' HB2' HG23 ' A' ' 25' ' ' ILE . 5.3 t-20 -54.92 117.93 15.66 Favored Pre-proline 0 C--N 1.311 -1.105 0 CA-C-N 114.689 -1.141 . . . . 0.0 111.939 -179.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -81.16 14.62 2.06 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.682 2.254 . . . . 0.0 111.556 179.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.471 ' CD2' ' SD ' ' A' ' 71' ' ' MET . 22.9 t80 -119.46 -55.74 2.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.146 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.717 ' HB3' ' CG1' ' A' ' 25' ' ' ILE . 0.7 OUTLIER -72.83 -10.67 60.06 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.152 -179.712 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.621 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 11.0 p -58.2 98.31 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.409 -179.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.639 ' O ' ' N ' ' A' ' 22' ' ' GLY . 6.1 mt-30 -121.96 152.76 60.14 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.905 178.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -45.28 75.79 0.01 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.178 0 C-N-CA 122.734 2.29 . . . . 0.0 112.638 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.639 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 127.86 2.76 6.09 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.556 -0.831 . . . . 0.0 113.269 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.568 ' HB2' ' C8 ' ' A' ' 178' ' ' NAG . . . -160.19 98.17 1.46 Allowed Pre-proline 0 CA--C 1.514 -0.432 0 CA-C-O 122.084 0.945 . . . . 0.0 111.769 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.621 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 98.6 Cg_endo -107.73 81.7 0.02 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.575 0 C-N-CA 125.235 3.956 . . . . 0.0 113.5 -178.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.854 HG21 HG22 ' A' ' 76' ' ' VAL . 23.0 mm -44.75 -177.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.807 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -147.56 -158.79 0.95 Allowed 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 -175.386 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.506 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 6.9 tm0? 161.85 94.85 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 112.431 -2.168 . . . . 0.0 109.601 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.752 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -36.01 110.71 0.11 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.9 -178.292 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.658 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.1 tpt -44.27 -78.08 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.938 0.399 . . . . 0.0 110.068 178.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 110.98 55.27 0.51 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.725 -0.75 . . . . 0.0 113.118 179.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.506 ' O ' ' HA ' ' A' ' 9' ' ' GLU . 16.7 t -124.96 62.68 1.15 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.944 0.402 . . . . 0.0 110.308 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.47 ' O ' ' O ' ' A' ' 33' ' ' PHE . 0.1 OUTLIER -80.71 23.51 0.53 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.018 -179.19 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.479 ' O ' ' HB3' ' A' ' 34' ' ' SER . 89.3 m-85 55.71 158.34 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.86 0.362 . . . . 0.0 110.771 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.497 ' OG ' ' O ' ' A' ' 34' ' ' SER . 1.0 OUTLIER 173.22 44.96 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.538 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.494 ' CB ' ' O ' ' A' ' 34' ' ' SER . 0.1 OUTLIER 84.97 -167.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.794 -179.844 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -112.92 117.42 32.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.068 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.489 ' C ' ' CD1' ' A' ' 37' ' ' TYR . 0.9 OUTLIER 46.92 87.34 0.12 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.805 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 37' ' ' TYR . 2.2 Cg_endo -41.24 133.98 3.0 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 122.597 2.198 . . . . 0.0 111.546 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.586 ' HB ' ' HD3' ' A' ' 40' ' ' PRO . 1.4 m -148.33 -64.7 0.02 OUTLIER Pre-proline 0 C--N 1.327 -0.408 0 CA-C-O 121.492 0.663 . . . . 0.0 111.339 -179.264 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.586 ' HD3' ' HB ' ' A' ' 39' ' ' THR . 39.2 Cg_endo -68.71 81.63 0.58 Allowed 'Trans proline' 0 C--N 1.325 -0.674 0 C-N-CA 123.693 2.928 . . . . 0.0 112.306 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.544 ' O ' ' C ' ' A' ' 42' ' ' ARG . 2.6 mp -90.05 -43.01 10.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.006 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.544 ' C ' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -18.35 130.06 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.622 -179.696 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.51 ' CB ' HG22 ' A' ' 46' ' ' THR . 0.1 OUTLIER -178.12 67.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.698 -179.891 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.51 -28.56 56.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.897 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.57 73.35 1.43 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.896 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.51 HG22 ' CB ' ' A' ' 43' ' ' SER . 0.2 OUTLIER -88.76 -23.86 22.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.702 179.966 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.475 ' C ' ' O ' ' A' ' 46' ' ' THR . 0.0 OUTLIER 29.52 90.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.999 179.797 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 48' ' ' LEU . 0.9 OUTLIER -88.43 126.31 35.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.304 0.573 . . . . 0.0 111.045 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.565 ' O ' ' CG1' ' A' ' 49' ' ' VAL . 0.5 OUTLIER 172.75 8.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.92 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.533 ' O ' ' CB ' ' A' ' 51' ' ' LYS . 38.1 mm-40 -134.2 156.73 47.85 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.106 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.533 ' CB ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER 84.73 146.79 0.07 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.877 0.37 . . . . 0.0 110.573 -179.721 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.566 ' O ' ' O ' ' A' ' 53' ' ' VAL . 3.4 p30 -72.87 153.66 40.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.427 -179.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.566 ' O ' ' O ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER 23.47 106.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.2 179.652 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -92.85 -58.68 2.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.835 179.478 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.405 ' OG ' ' O ' ' A' ' 55' ' ' SER . 25.6 p 45.61 76.43 0.09 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.173 179.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -102.85 19.18 19.83 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.957 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.7 t -157.23 76.49 0.84 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.072 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.486 ' O ' ' HB3' ' A' ' 59' ' ' CYS . 7.2 p -71.33 163.03 28.45 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.931 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.501 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 0.8 OUTLIER 176.09 123.65 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.979 0.419 . . . . 0.0 111.927 179.868 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.605 ' O ' ' N ' ' A' ' 62' ' ' ALA . 5.3 p -113.28 43.59 1.71 Allowed 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.628 178.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.562 ' O ' ' C ' ' A' ' 62' ' ' ALA . 30.9 m -58.15 75.34 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.08 179.366 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.612 ' HB3' ' CG ' ' A' ' 79' ' ' HIS . . . 18.08 103.89 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.656 -178.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.973 ' N ' ' O ' ' A' ' 81' ' ' ALA . 6.5 tppt? -52.84 -31.82 41.22 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 121.971 0.891 . . . . 0.0 108.858 178.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.598 ' HB3' ' OG1' ' A' ' 80' ' ' THR . 3.7 t -144.21 152.05 40.33 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 113.806 -1.543 . . . . 0.0 108.535 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.656 ' CG ' ' CG ' ' A' ' 77' ' ' GLU . 1.8 p90 -135.69 164.83 26.98 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.575 0.702 . . . . 0.0 112.093 -179.272 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.697 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 6.6 t-20 -134.66 26.36 3.7 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 122.76 1.267 . . . . 0.0 108.42 177.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.687 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -9.95 132.09 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 112.007 -2.36 . . . . 0.0 112.371 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.801 ' O ' HG21 ' A' ' 68' ' ' VAL . 2.2 m -140.02 44.19 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.873 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.663 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 45.5 m -10.3 119.1 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.888 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.538 ' CG1' ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -116.58 -168.68 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.577 0.704 . . . . 0.0 112.082 179.748 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.649 ' HG3' ' CG ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER 27.96 -139.33 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.581 -1.19 . . . . 0.0 110.954 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -69.5 10.21 2.14 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.614 179.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.46 ' N ' ' O ' ' A' ' 70' ' ' VAL . . . 129.26 55.58 0.1 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.986 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.663 ' O ' ' HA ' ' A' ' 69' ' ' THR . 2.0 m-85 -95.33 108.57 20.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.988 0.423 . . . . 0.0 111.051 -179.614 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.455 ' HG2' ' OG1' ' A' ' 69' ' ' THR . 5.3 mtpt -96.44 100.26 11.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.369 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.854 HG22 HG21 ' A' ' 25' ' ' ILE . 22.6 m -87.38 11.8 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.339 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.307 179.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.748 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 30.68 39.11 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 -177.094 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.697 ' HB3' ' HB3' ' A' ' 66' ' ' ASN . 52.3 t30 -3.68 67.45 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 112.98 -1.918 . . . . 0.0 109.092 -174.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.748 ' N ' ' O ' ' A' ' 77' ' ' GLU . 42.3 m170 -37.18 119.45 0.68 Allowed 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 112.802 -1.999 . . . . 0.0 114.362 -176.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.598 ' OG1' ' HB3' ' A' ' 64' ' ' SER . 0.7 OUTLIER -108.95 -7.37 15.42 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 113.552 -1.658 . . . . 0.0 109.926 178.136 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.973 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -168.91 122.08 0.81 Allowed 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.98 178.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.456 ' SG ' ' HA ' ' A' ' 62' ' ' ALA . 1.3 m -119.11 120.09 36.12 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.653 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.96 ' CD2' ' HB2' ' A' ' 63' ' ' LYS . 5.5 m170 -123.69 117.9 26.03 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.1 0.476 . . . . 0.0 112.237 -178.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.533 ' O ' ' HB2' ' A' ' 85' ' ' SER . 0.5 OUTLIER -79.54 122.42 26.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.239 179.792 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.533 ' HB2' ' O ' ' A' ' 84' ' ' CYS . 24.0 t 162.48 151.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.629 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.437 ' C ' ' O ' ' A' ' 85' ' ' SER . 3.7 m -36.48 133.57 0.52 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.798 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -124.25 163.83 20.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.628 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.513 ' O ' ' C ' ' A' ' 89' ' ' TYR . 0.1 OUTLIER -179.83 47.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.131 179.933 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.513 ' C ' ' O ' ' A' ' 88' ' ' TYR . 3.2 m-85 24.88 85.95 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.244 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.617 ' O ' ' C ' ' A' ' 91' ' ' LYS . 7.3 p-80 -90.18 -33.48 16.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.906 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.617 ' C ' ' O ' ' A' ' 90' ' ' HIS . 3.3 tttm 6.06 70.25 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.519 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.473 ' N ' ' O ' ' A' ' 90' ' ' HIS . 38.5 t . . . . . 0 C--O 1.247 0.966 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.876 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.654 ' C6 ' ' H1 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.654 ' H1 ' ' C6 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . 0.495 ' H1 ' ' H62' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.516 ' C6 ' ' O5 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.855 ' H3 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . 0.855 ' O2 ' ' H3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . 0.516 ' O5 ' ' C6 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.991 0.424 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -84.23 117.55 2.18 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 123.01 2.473 . . . . 0.0 112.725 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -125.07 -85.94 0.63 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.758 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -59.15 160.87 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.029 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.535 ' O ' ' CB ' ' A' ' 6' ' ' ASP . 0.2 OUTLIER -91.99 -165.44 1.35 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.93 179.929 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.535 ' CB ' ' O ' ' A' ' 5' ' ' GLN . 5.7 t0 86.74 -147.28 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.605 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 45.9 t -156.12 129.35 4.43 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.808 0.337 . . . . 0.0 111.038 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -51.66 165.54 0.71 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.696 2.264 . . . . 0.0 112.343 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.562 ' CG ' ' CZ ' ' A' ' 33' ' ' PHE . 0.5 OUTLIER -67.08 119.29 11.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.738 179.799 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.687 ' HB2' ' N ' ' A' ' 32' ' ' CYS . 1.8 t -59.21 100.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.168 -179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.489 ' O ' ' N ' ' A' ' 29' ' ' MET . 0.0 OUTLIER -162.76 164.72 26.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.92 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.858 HD22 ' O ' ' A' ' 79' ' ' HIS . 1.4 mp -60.35 124.25 19.76 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.648 ' HG3' ' CB ' ' A' ' 29' ' ' MET . 0.7 OUTLIER -116.67 60.52 0.74 Allowed 'General case' 0 CA--C 1.502 -0.867 0 CA-C-O 122.044 0.925 . . . . 0.0 111.723 -179.257 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.648 ' CD ' ' HB2' ' A' ' 24' ' ' PRO . 33.3 tt0 3.92 120.42 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 112.949 -1.932 . . . . 0.0 111.459 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.714 ' HB2' HG23 ' A' ' 25' ' ' ILE . 0.5 OUTLIER -53.89 100.74 0.23 Allowed Pre-proline 0 C--N 1.307 -1.264 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.562 -179.608 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.612 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 56.8 Cg_endo -69.98 5.4 1.8 Allowed 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 121.702 1.602 . . . . 0.0 109.951 178.054 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.601 ' HB3' ' CD1' ' A' ' 18' ' ' PHE . 0.3 OUTLIER -101.47 -60.64 1.49 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 113.992 -1.458 . . . . 0.0 110.847 -179.779 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.737 ' CE2' HG22 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -82.67 -2.17 53.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.651 -179.576 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.603 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -59.27 83.77 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.598 179.647 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.493 ' O ' ' N ' ' A' ' 22' ' ' GLY . 4.2 mt-30 -92.94 164.88 20.09 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.407 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.16 59.22 0.17 Allowed 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 122.527 2.151 . . . . 0.0 111.174 179.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 154.7 -14.93 0.53 Allowed Glycine 0 N--CA 1.449 -0.461 0 CA-C-N 115.716 -0.674 . . . . 0.0 112.549 -179.379 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.614 ' CB ' ' H81' ' A' ' 178' ' ' NAG . . . -142.52 105.16 5.45 Favored Pre-proline 0 CA--C 1.513 -0.448 0 CA-C-O 121.916 0.865 . . . . 0.0 111.374 -179.588 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.732 ' HD2' ' H3 ' ' A' ' 178' ' ' NAG . 71.9 Cg_endo -104.05 75.93 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.391 0 C-N-CA 124.687 3.592 . . . . 0.0 114.358 -177.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.864 HG22 HG23 ' A' ' 76' ' ' VAL . 15.2 mm -44.17 -175.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 178.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.828 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -148.65 -161.19 1.29 Allowed 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -176.879 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.637 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 20.8 tt0 161.79 82.91 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 112.421 -2.172 . . . . 0.0 110.822 179.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 1.3 m -35.06 101.83 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.774 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.648 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -110.33 143.91 39.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.889 0.376 . . . . 0.0 111.225 179.796 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.602 ' HA2' ' HA ' ' A' ' 10' ' ' CYS . . . 131.89 -159.08 23.14 Favored Glycine 0 C--N 1.33 0.23 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.445 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.508 ' O ' ' O ' ' A' ' 32' ' ' CYS . 90.8 m -148.93 91.0 1.81 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.802 0.334 . . . . 0.0 111.039 -179.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.687 ' N ' ' HB2' ' A' ' 10' ' ' CYS . 0.1 OUTLIER 31.27 -154.68 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.058 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.562 ' CZ ' ' CG ' ' A' ' 9' ' ' GLU . 2.5 m-85 -131.54 167.78 18.8 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.821 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.542 ' O ' ' N ' ' A' ' 36' ' ' ALA . 1.2 m -108.1 -139.07 0.37 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.978 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -62.05 66.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.209 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.542 ' N ' ' O ' ' A' ' 34' ' ' SER . . . -65.74 123.98 21.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.153 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.531 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.5 OUTLIER 86.41 90.73 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.058 179.887 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.461 ' O ' HG21 ' A' ' 39' ' ' THR . 10.6 Cg_exo -70.57 -149.85 0.03 OUTLIER 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.916 2.41 . . . . 0.0 112.269 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.556 ' O ' ' CG2' ' A' ' 39' ' ' THR . 0.4 OUTLIER 80.12 111.26 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.757 -179.941 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -65.04 163.85 27.17 Favored 'Trans proline' 0 N--CA 1.465 -0.184 0 C-N-CA 122.791 2.327 . . . . 0.0 112.086 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -137.33 -173.09 3.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.89 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.546 ' CZ ' ' HB2' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -163.66 137.51 5.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.618 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.469 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 11.0 t 65.98 90.71 0.09 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.832 0.349 . . . . 0.0 110.59 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.74 24.43 4.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 -179.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.412 ' C ' ' OG1' ' A' ' 46' ' ' THR . 0.0 OUTLIER -56.92 -21.08 27.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.006 -179.924 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.701 ' O ' ' CB ' ' A' ' 47' ' ' MET . 0.0 OUTLIER 176.48 108.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.708 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.701 ' CB ' ' O ' ' A' ' 46' ' ' THR . 2.2 tmm? 126.68 89.08 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.429 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.517 ' N ' HD21 ' A' ' 48' ' ' LEU . 1.1 pt? -151.64 30.29 0.59 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.539 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 0.1 OUTLIER -31.6 112.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.089 179.938 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.582 ' O ' ' CB ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER 82.6 179.75 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.919 -179.88 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.582 ' CB ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER 95.49 176.69 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.006 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.45 ' HB2' ' O ' ' A' ' 51' ' ' LYS . 0.8 OUTLIER 79.3 51.12 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.641 -179.812 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.634 ' O ' ' CB ' ' A' ' 54' ' ' THR . 0.1 OUTLIER -150.6 167.48 2.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.278 -179.652 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.634 ' CB ' ' O ' ' A' ' 53' ' ' VAL . 1.7 m 143.16 153.33 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.608 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.482 ' HB2' ' O ' ' A' ' 54' ' ' THR . 9.8 m 77.49 151.89 0.13 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.958 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 25.8 pt-20 -43.56 145.4 0.63 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.997 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 169.66 -94.78 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.552 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.461 HG23 ' HB3' ' A' ' 84' ' ' CYS . 0.0 OUTLIER -49.1 166.79 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.457 -179.482 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.555 ' N ' ' O ' ' A' ' 85' ' ' SER . 35.1 m -151.0 132.92 15.1 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.01 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.7 m -82.06 101.14 10.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.209 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.587 ' O ' ' C ' ' A' ' 62' ' ' ALA . 7.1 p -111.65 70.92 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.739 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.587 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 9.11 107.31 0.0 OUTLIER 'General case' 0 C--O 1.231 0.103 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.164 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.882 ' N ' ' O ' ' A' ' 81' ' ' ALA . 2.4 ttmm -55.35 -39.3 69.89 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.652 0.739 . . . . 0.0 109.372 178.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.503 ' N ' ' HB3' ' A' ' 81' ' ' ALA . 2.4 m -144.13 135.03 25.23 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.108 179.362 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.822 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.2 OUTLIER -119.45 160.59 22.06 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.128 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.92 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -123.6 27.65 7.29 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-O 122.5 1.143 . . . . 0.0 107.938 177.423 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.539 ' O ' ' O ' ' A' ' 66' ' ' ASN . 1.9 ttm180 -6.33 128.67 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 112.311 -2.222 . . . . 0.0 112.237 -179.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.78 ' O ' HG21 ' A' ' 70' ' ' VAL . 1.5 m -134.64 36.04 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.954 179.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.594 ' C ' ' O ' ' A' ' 68' ' ' VAL . 23.4 m -17.34 120.55 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.471 -179.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.78 HG21 ' O ' ' A' ' 68' ' ' VAL . 0.2 OUTLIER -125.92 -168.01 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-O 121.718 0.771 . . . . 0.0 112.447 -178.457 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.597 ' SD ' ' CZ ' ' A' ' 17' ' ' PHE . 0.5 OUTLIER 43.86 -134.49 0.57 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.411 -1.268 . . . . 0.0 111.062 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.406 ' H ' ' HB3' ' A' ' 71' ' ' MET . . . -84.94 23.02 8.25 Favored Glycine 0 N--CA 1.434 -1.45 0 C-N-CA 120.71 -0.757 . . . . 0.0 111.694 179.473 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 118.03 37.09 0.9 Allowed Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.183 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.569 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 3.3 m-85 -68.64 -177.66 1.0 Allowed 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 1.5 mtmp? -159.53 134.37 7.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.273 0.559 . . . . 0.0 111.972 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.864 HG23 HG22 ' A' ' 25' ' ' ILE . 18.8 m -140.07 15.22 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.492 -1.255 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.476 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.822 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 20.42 46.58 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -178.069 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.92 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 27.4 t-20 1.18 70.78 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 114.262 -1.335 . . . . 0.0 108.215 -174.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.858 ' O ' HD22 ' A' ' 12' ' ' LEU . 33.6 m170 -39.36 111.42 0.18 Allowed 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 122.582 1.182 . . . . 0.0 111.957 -176.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.592 ' CG2' ' HB2' ' A' ' 66' ' ' ASN . 8.9 p -108.16 -9.33 15.58 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.601 -1.636 . . . . 0.0 110.101 -179.375 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.882 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -165.42 128.55 2.19 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 178.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.509 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.1 OUTLIER -117.67 143.39 46.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.668 0.271 . . . . 0.0 110.753 -178.935 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.441 ' NE2' ' HA ' ' A' ' 63' ' ' LYS . 0.3 OUTLIER -152.97 116.12 4.62 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.867 0.365 . . . . 0.0 111.516 -179.473 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.461 ' HB3' HG23 ' A' ' 58' ' ' THR . 0.5 OUTLIER -61.07 127.38 31.26 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.512 179.44 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.555 ' O ' ' N ' ' A' ' 59' ' ' CYS . 0.4 OUTLIER -149.46 -153.29 0.48 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.764 -179.957 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.5 34.17 0.82 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.947 0.403 . . . . 0.0 110.587 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.479 ' O ' ' O ' ' A' ' 88' ' ' TYR . 0.0 OUTLIER 45.78 -169.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.809 -179.87 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.479 ' O ' ' O ' ' A' ' 87' ' ' CYS . 2.6 p90 -38.27 163.8 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.928 0.394 . . . . 0.0 111.284 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.431 ' HB3' ' CE1' ' A' ' 90' ' ' HIS . 14.1 m-85 -130.72 -92.62 0.42 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.537 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.431 ' CE1' ' HB3' ' A' ' 89' ' ' TYR . 0.0 OUTLIER -131.55 86.74 2.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.548 179.535 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.416 ' HB3' ' O ' ' A' ' 90' ' ' HIS . 3.2 ttmt 65.41 118.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.778 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.183 -0.913 . . . . 0.0 110.906 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.732 ' H3 ' ' HD2' ' A' ' 24' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.576 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . 0.437 ' H61' ' H2 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . 0.437 ' H2 ' ' H61' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.742 ' H3 ' ' O2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . 0.742 ' O2 ' ' H3 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.262 0 CA-C-O 120.838 0.351 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.486 ' O ' ' O ' ' A' ' 3' ' ' ASP . 94.0 Cg_exo -38.11 -39.18 0.9 Allowed 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.912 2.408 . . . . 0.0 112.481 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.486 ' O ' ' O ' ' A' ' 2' ' ' PRO . 0.2 OUTLIER 35.65 -158.88 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.983 179.912 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.544 HG11 ' N ' ' A' ' 5' ' ' GLN . 47.2 t -110.59 146.66 15.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.114 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.544 ' N ' HG11 ' A' ' 4' ' ' VAL . 23.9 mt-30 -106.92 81.73 1.6 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.83 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.515 ' CB ' ' O ' ' A' ' 5' ' ' GLN . 0.0 OUTLIER 162.21 159.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.849 0.357 . . . . 0.0 111.202 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 6' ' ' ASP . 0.5 OUTLIER 174.27 151.07 0.25 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.986 179.608 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.621 ' O ' ' HB2' ' A' ' 31' ' ' CYS . 65.9 Cg_endo -81.38 -123.45 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.888 2.392 . . . . 0.0 110.36 178.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.574 ' O ' ' N ' ' A' ' 11' ' ' THR . 2.1 mp0 -149.22 -175.76 5.1 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.052 0.453 . . . . 0.0 110.704 178.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.655 ' N ' ' O ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -47.29 86.52 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.829 179.867 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.593 ' O ' ' N ' ' A' ' 29' ' ' MET . 0.0 OUTLIER -115.19 156.04 26.06 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.388 -178.944 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.857 HD22 ' O ' ' A' ' 79' ' ' HIS . 3.5 mp -51.2 123.07 8.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.243 179.509 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.704 ' O ' ' O ' ' A' ' 14' ' ' GLU . 2.0 mm-40 -123.34 61.45 1.05 Allowed 'General case' 0 CA--C 1.502 -0.895 0 CA-C-O 122.251 1.024 . . . . 0.0 110.933 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.704 ' O ' ' O ' ' A' ' 13' ' ' GLN . 16.6 tt0 8.29 126.92 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 112.484 -2.144 . . . . 0.0 112.313 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.613 ' ND2' ' CG2' ' A' ' 25' ' ' ILE . 1.4 t-20 -49.86 128.96 21.11 Favored Pre-proline 0 C--N 1.311 -1.096 0 CA-C-N 114.232 -1.349 . . . . 0.0 111.253 179.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -86.06 27.87 0.57 Allowed 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.598 2.198 . . . . 0.0 111.517 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.537 ' HB2' ' CE ' ' A' ' 71' ' ' MET . 54.2 t80 -143.29 -52.65 0.36 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.924 -179.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.768 ' CE2' HG21 ' A' ' 68' ' ' VAL . 0.2 OUTLIER -74.86 -15.43 60.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.28 -179.163 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.914 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -55.5 92.54 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.315 -179.547 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.541 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.1 OUTLIER -121.07 166.51 15.66 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-O 120.916 0.388 . . . . 0.0 111.147 179.803 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.476 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 31.2 Cg_exo -59.28 64.46 0.06 OUTLIER 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.992 2.461 . . . . 0.0 112.194 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.541 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 144.94 -9.89 1.81 Allowed Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.35 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.499 ' O ' ' O ' ' A' ' 18' ' ' PHE . . . -153.19 99.13 2.71 Favored Pre-proline 0 CA--C 1.51 -0.583 0 CA-C-O 122.02 0.914 . . . . 0.0 111.798 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.914 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 71.7 Cg_endo -107.64 72.71 0.02 OUTLIER 'Trans proline' 0 N--CA 1.436 -1.878 0 C-N-CA 124.965 3.777 . . . . 0.0 113.251 -178.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.843 HG21 HG22 ' A' ' 76' ' ' VAL . 22.7 mm -40.09 -176.89 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.043 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.158 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.839 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -148.58 -159.58 1.05 Allowed 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 122.484 1.135 . . . . 0.0 113.826 -176.356 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.524 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 1.2 tp-100 160.01 75.29 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 112.921 -1.945 . . . . 0.0 110.802 179.646 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.568 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 2.3 m -22.74 111.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.618 -179.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.593 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.8 OUTLIER -144.69 130.5 19.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.638 179.64 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 173.13 -115.49 0.56 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.164 -1.017 . . . . 0.0 113.54 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.655 ' O ' ' N ' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -115.35 -164.36 0.94 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.276 0.56 . . . . 0.0 111.706 -179.263 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.645 ' CB ' ' O ' ' A' ' 31' ' ' CYS . 4.1 t 106.34 -139.31 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.98 -1.009 . . . . 0.0 109.811 -179.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.641 ' CD1' HG22 ' A' ' 58' ' ' THR . 0.0 OUTLIER 56.07 -166.48 0.12 Allowed 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.585 179.025 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -147.22 -168.37 3.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.961 0.41 . . . . 0.0 111.364 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -77.18 144.55 38.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.133 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -110.23 20.01 18.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.912 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.424 ' O ' ' O ' ' A' ' 38' ' ' PRO . 0.9 OUTLIER -118.65 120.5 31.66 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.915 -179.968 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.424 ' O ' ' O ' ' A' ' 37' ' ' TYR . 96.3 Cg_exo -46.25 179.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.219 0 C-N-CA 122.683 2.256 . . . . 0.0 112.372 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.555 ' OG1' ' HD2' ' A' ' 40' ' ' PRO . 1.3 t 169.57 155.05 0.18 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.784 -179.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.555 ' HD2' ' OG1' ' A' ' 39' ' ' THR . 90.4 Cg_exo -30.68 -38.08 0.05 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 122.814 2.343 . . . . 0.0 112.022 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.493 ' O ' ' O ' ' A' ' 39' ' ' THR . 0.1 OUTLIER -73.16 -173.53 1.33 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.639 179.688 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.457 ' O ' ' HD3' ' A' ' 44' ' ' LYS . 5.1 mtp-105 -158.86 -37.43 0.06 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.52 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.506 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 1.1 m 41.63 -149.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.893 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 43' ' ' SER . 0.1 OUTLIER 68.76 33.16 3.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.184 179.893 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.45 ' O ' ' O ' ' A' ' 46' ' ' THR . 9.0 ttpp -115.2 -37.85 3.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.63 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.45 ' O ' ' O ' ' A' ' 45' ' ' LYS . 24.1 p 44.48 -173.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.934 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.2 -74.28 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.122 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.436 ' C ' ' CG2' ' A' ' 49' ' ' VAL . 0.9 OUTLIER -145.0 71.91 1.31 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.94 -179.747 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.436 ' CG2' ' C ' ' A' ' 48' ' ' LEU . 1.2 t 69.87 -144.82 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.142 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.533 ' O ' ' N ' ' A' ' 52' ' ' ASN . 0.3 OUTLIER -174.63 105.42 0.1 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.561 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.522 ' O ' ' HB2' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -56.47 77.75 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.153 -179.546 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.533 ' N ' ' O ' ' A' ' 50' ' ' GLN . 10.9 t-20 174.64 104.26 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.907 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.2 m -53.31 175.14 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.827 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 60.9 p 51.01 93.57 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.933 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -161.89 125.31 3.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.918 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -145.27 -35.55 0.31 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.096 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 38.3 m -133.58 -95.36 0.3 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.781 0.324 . . . . 0.0 111.096 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.641 HG22 ' CD1' ' A' ' 33' ' ' PHE . 0.2 OUTLIER -59.97 -165.71 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.969 0.414 . . . . 0.0 111.059 -179.892 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.574 ' O ' ' O ' ' A' ' 83' ' ' HIS . 1.8 t -162.23 28.04 0.11 Allowed 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.788 0.804 . . . . 0.0 110.66 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.62 ' O ' ' CB ' ' A' ' 61' ' ' VAL . 0.1 OUTLIER -74.57 -162.38 0.16 Allowed 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.538 179.333 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.643 ' O ' ' O ' ' A' ' 62' ' ' ALA . 4.3 p 116.08 42.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 114.291 -1.322 . . . . 0.0 109.317 -179.691 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.643 ' O ' ' O ' ' A' ' 61' ' ' VAL . . . 37.29 113.78 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.527 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.74 ' N ' ' O ' ' A' ' 81' ' ' ALA . 4.3 ttmm -52.33 -39.66 60.93 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.674 0.75 . . . . 0.0 109.014 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.514 ' O ' ' N ' ' A' ' 80' ' ' THR . 4.4 m -141.13 139.78 34.01 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.971 178.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.649 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 7.2 p90 -123.51 159.38 29.24 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.181 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.92 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -126.71 26.07 6.3 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 122.825 1.298 . . . . 0.0 107.826 176.87 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.579 ' HA ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -3.0 129.75 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 111.912 -2.404 . . . . 0.0 113.766 -179.273 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.768 HG21 ' CE2' ' A' ' 18' ' ' PHE . 1.9 m -149.26 87.7 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.962 178.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.643 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 98.7 m -57.5 127.0 29.82 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.6 0.714 . . . . 0.0 111.955 -178.04 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.682 ' CG1' ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -126.27 -170.23 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 114.684 -1.144 . . . . 0.0 111.124 179.383 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.537 ' CE ' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER 30.55 -136.55 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.058 179.592 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -73.23 21.57 1.06 Allowed Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.695 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.638 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 115.54 33.75 1.54 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.555 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.643 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.2 m-85 -69.0 110.46 4.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.106 0.479 . . . . 0.0 111.233 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.423 ' C ' ' H ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -95.81 89.63 5.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.807 179.82 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.843 HG22 HG21 ' A' ' 25' ' ' ILE . 25.5 m -78.76 13.89 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.495 -1.155 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.904 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.7 ' O ' ' C ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER 23.76 44.74 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 105.685 -1.969 . . . . 0.0 105.685 -177.698 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.92 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 26.6 t-20 1.48 71.96 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.096 0 CA-C-N 114.196 -1.365 . . . . 0.0 108.371 -174.22 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.857 ' O ' HD22 ' A' ' 12' ' ' LEU . 36.4 m170 -41.85 111.6 0.25 Allowed 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 122.644 1.211 . . . . 0.0 111.93 -176.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.538 ' CG2' ' HB2' ' A' ' 66' ' ' ASN . 7.6 p -104.53 -3.32 24.05 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 113.6 -1.637 . . . . 0.0 109.628 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.74 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -171.96 138.6 1.05 Allowed 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.2 OUTLIER -120.86 157.24 30.23 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.729 -0.389 . . . . 0.0 111.325 -179.031 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.574 ' O ' ' O ' ' A' ' 59' ' ' CYS . 0.4 OUTLIER -165.75 106.22 0.73 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.343 179.553 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.579 ' HB3' ' SG ' ' A' ' 60' ' ' CYS . 3.9 p -118.38 160.2 22.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.441 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.491 ' C ' ' O ' ' A' ' 84' ' ' CYS . 3.7 p 28.68 37.17 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.923 0.392 . . . . 0.0 110.959 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.569 ' N ' ' O ' ' A' ' 84' ' ' CYS . 0.2 OUTLIER -170.39 50.54 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.604 -179.743 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 86.2 m -80.56 51.37 1.46 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.918 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.567 ' O ' ' CB ' ' A' ' 89' ' ' TYR . 0.4 OUTLIER -152.61 -160.19 1.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.79 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.567 ' CB ' ' O ' ' A' ' 88' ' ' TYR . 0.2 OUTLIER 90.69 -72.66 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.909 -179.898 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.465 ' O ' ' O ' ' A' ' 91' ' ' LYS . 1.6 t60 -104.79 137.87 41.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.87 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.465 ' O ' ' O ' ' A' ' 90' ' ' HIS . 0.0 OUTLIER 39.19 97.6 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.991 179.901 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.8 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.891 -179.942 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.58 ' H3 ' ' HD2' ' A' ' 24' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.563 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . 0.508 ' H1 ' ' C6 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . 0.439 ' H3 ' ' O4 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . 0.504 ' H1 ' ' H4 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.579 ' H3 ' ' O5 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . 0.579 ' O5 ' ' H3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.447 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.284 0 CA-C-O 120.872 0.368 . . . . 0.0 111.102 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.447 ' HD2' ' N ' ' A' ' 1' ' ' ALA . 58.6 Cg_endo -72.09 -91.59 0.01 OUTLIER 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.912 2.408 . . . . 0.0 112.486 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.4 ' O ' ' HB ' ' A' ' 4' ' ' VAL . 0.2 OUTLIER 50.14 50.46 18.55 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.757 -179.933 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.4 ' HB ' ' O ' ' A' ' 3' ' ' ASP . 11.5 t 74.99 83.52 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.007 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -142.07 96.83 3.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.673 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.427 ' OD1' ' HG2' ' A' ' 8' ' ' PRO . 1.8 p30 -141.35 176.07 9.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.977 -179.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.549 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -68.54 -60.49 4.68 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.14 179.944 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.555 ' O ' ' HB3' ' A' ' 9' ' ' GLU . 14.8 Cg_exo -32.87 104.94 0.03 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 123.18 2.587 . . . . 0.0 112.388 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.555 ' HB3' ' O ' ' A' ' 8' ' ' PRO . 32.5 tt0 83.09 116.96 0.05 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.329 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.462 ' C ' ' CG2' ' A' ' 11' ' ' THR . 0.1 OUTLIER -82.98 151.72 25.74 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.215 179.419 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.903 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.2 OUTLIER -168.99 -135.14 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.326 179.917 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.903 ' N ' ' OG1' ' A' ' 11' ' ' THR . 0.5 OUTLIER -114.38 129.71 56.66 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.668 179.83 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.655 ' HG3' ' CB ' ' A' ' 29' ' ' MET . 1.8 mm-40 -97.84 44.83 1.03 Allowed 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 121.7 0.762 . . . . 0.0 110.81 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.735 ' HG2' ' HB2' ' A' ' 24' ' ' PRO . 5.9 tt0 -5.22 122.8 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 113.617 -1.629 . . . . 0.0 110.945 -179.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.789 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.6 OUTLIER -69.38 105.07 0.91 Allowed Pre-proline 0 C--N 1.309 -1.156 0 CA-C-N 114.691 -1.14 . . . . 0.0 113.095 -178.343 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.535 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 3.7 Cg_exo -78.33 3.81 6.82 Favored 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 122.819 2.346 . . . . 0.0 109.472 177.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.483 ' HB3' ' OD1' ' A' ' 15' ' ' ASN . 1.3 t80 -94.61 -63.35 1.19 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 113.874 -1.512 . . . . 0.0 110.08 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.708 ' CD1' ' CG2' ' A' ' 70' ' ' VAL . 8.4 m-85 -79.7 -0.39 33.89 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.362 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.694 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -53.94 104.18 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.942 -179.793 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.602 ' N ' ' O ' ' A' ' 23' ' ' ALA . 0.3 OUTLIER -106.43 177.17 1.41 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.833 179.85 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.489 ' HD2' ' HB2' ' A' ' 20' ' ' GLN . 35.1 Cg_exo -59.55 68.23 0.06 OUTLIER 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.676 2.251 . . . . 0.0 112.018 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.511 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 124.65 19.51 2.51 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.395 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.698 ' CB ' ' C8 ' ' A' ' 178' ' ' NAG . . . -167.0 100.77 0.64 Allowed Pre-proline 0 CA--C 1.509 -0.61 0 CA-C-O 121.952 0.882 . . . . 0.0 110.971 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.793 ' O ' ' O ' ' A' ' 25' ' ' ILE . 28.1 Cg_endo -94.35 23.85 0.42 Allowed 'Trans proline' 0 N--CA 1.452 -0.968 0 C-N-CA 124.525 3.484 . . . . 0.0 113.049 -178.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.852 ' CG2' ' H ' ' A' ' 26' ' ' LEU . 9.8 mm 25.38 -174.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 114.684 -1.144 . . . . 0.0 113.046 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.852 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -159.75 -160.61 0.83 Allowed 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -174.723 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.58 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 2.6 tp60 161.27 59.5 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 112.176 -2.284 . . . . 0.0 110.477 179.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.655 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 73.6 m -15.87 121.29 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.266 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.655 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -156.68 127.96 6.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.757 179.063 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 170.9 -130.81 2.06 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.324 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 70.7 m -144.24 118.98 9.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.77 0.319 . . . . 0.0 110.824 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.607 ' O ' ' CD1' ' A' ' 33' ' ' PHE . 33.8 t -57.11 -66.75 0.4 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.92 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.607 ' CD1' ' O ' ' A' ' 32' ' ' CYS . 0.7 OUTLIER 162.03 -79.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.827 -179.86 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.501 ' C ' ' O ' ' A' ' 33' ' ' PHE . 1.4 t 27.42 90.19 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.071 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.499 ' C ' ' O ' ' A' ' 34' ' ' SER . 7.9 ttm180 -25.76 139.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.481 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.479 ' HB3' ' HD3' ' A' ' 38' ' ' PRO . . . -133.36 -139.98 0.19 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.743 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.552 ' N ' ' HD3' ' A' ' 38' ' ' PRO . 1.0 OUTLIER -139.67 49.22 1.87 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 120.828 0.347 . . . . 0.0 111.024 179.907 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.552 ' HD3' ' N ' ' A' ' 37' ' ' TYR . 95.8 Cg_endo -84.0 122.49 2.97 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.849 2.366 . . . . 0.0 112.24 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.788 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 88.5 m -72.84 -34.12 2.36 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.409 0.623 . . . . 0.0 111.378 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.788 ' CD ' ' N ' ' A' ' 39' ' ' THR . 93.5 Cg_endo -88.62 104.18 0.44 Allowed 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 123.92 3.08 . . . . 0.0 112.837 -179.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 81.7 mt -132.98 -51.16 0.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.19 0.519 . . . . 0.0 109.93 179.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -128.56 11.11 6.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.001 179.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -168.69 135.4 1.88 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.345 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -83.21 52.35 2.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.209 -179.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.39 148.91 30.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.52 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.76 107.51 7.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.712 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.474 ' O ' ' O ' ' A' ' 48' ' ' LEU . 0.8 OUTLIER -162.5 62.52 0.21 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.218 -179.746 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.474 ' O ' ' O ' ' A' ' 47' ' ' MET . 0.1 OUTLIER 35.6 96.54 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.015 179.887 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.532 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -146.96 94.13 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.898 179.885 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.532 ' CB ' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER 156.62 92.5 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.196 -179.603 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.608 ' O ' ' CB ' ' A' ' 52' ' ' ASN . 7.5 ttpp -131.8 10.87 4.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.583 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.608 ' CB ' ' O ' ' A' ' 51' ' ' LYS . 2.9 m-20 150.15 147.47 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.459 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.54 ' CG1' ' O ' ' A' ' 52' ' ' ASN . 22.0 m -163.64 -164.25 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.664 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.615 ' O ' ' CB ' ' A' ' 55' ' ' SER . 0.0 OUTLIER -43.44 -86.55 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.651 179.686 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.615 ' CB ' ' O ' ' A' ' 54' ' ' THR . 2.1 m 146.66 54.51 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.797 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.497 ' CB ' ' O ' ' A' ' 55' ' ' SER . 2.0 tm-20 83.15 97.19 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.83 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.75 -170.77 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.893 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.416 HG23 ' HA ' ' A' ' 85' ' ' SER . 16.9 p -73.44 168.35 19.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.073 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.51 ' C ' ' HA ' ' A' ' 84' ' ' CYS . 30.0 p -145.04 129.34 17.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.014 0.435 . . . . 0.0 110.944 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.637 ' HB2' ' HB3' ' A' ' 82' ' ' CYS . 22.2 p -51.94 130.84 30.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.8 -179.48 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.586 ' CG1' ' O ' ' A' ' 61' ' ' VAL . 25.3 t -128.06 64.01 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.354 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.693 ' HA ' ' O ' ' A' ' 81' ' ' ALA . . . 26.18 92.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.431 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.86 ' N ' ' O ' ' A' ' 81' ' ' ALA . 8.6 tptp -47.04 -33.84 5.19 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 177.496 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.575 ' HB2' ' OG1' ' A' ' 80' ' ' THR . 0.0 OUTLIER -139.34 -175.61 4.24 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 113.833 -1.531 . . . . 0.0 108.646 178.982 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.855 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -158.88 162.98 37.0 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.554 0.692 . . . . 0.0 112.246 -179.466 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.781 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.2 OUTLIER -133.84 27.53 3.94 Favored 'General case' 0 CA--C 1.504 -0.817 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 176.777 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.641 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -8.66 129.9 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 112.205 -2.27 . . . . 0.0 111.935 -179.607 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.674 HG22 HG13 ' A' ' 25' ' ' ILE . 4.3 m -134.04 46.85 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.759 179.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.565 ' C ' ' O ' ' A' ' 68' ' ' VAL . 41.1 m -20.09 118.56 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.993 -178.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.708 ' CG2' ' CD1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -123.41 -170.0 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.109 -179.048 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.626 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 80.7 mtp 38.99 -134.23 0.14 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.635 179.57 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -75.87 12.33 8.99 Favored Glycine 0 N--CA 1.441 -0.992 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.976 -179.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 122.1 37.67 0.64 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.236 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.626 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 7.1 m-85 -67.14 -176.27 0.53 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.94 92.85 0.87 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.722 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.768 HG22 HG21 ' A' ' 25' ' ' ILE . 29.8 m -86.24 10.6 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.342 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.855 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.5 OUTLIER 30.53 39.38 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 -176.986 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.781 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 48.7 t30 1.75 64.69 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 113.081 -1.872 . . . . 0.0 108.26 -174.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.747 ' N ' HD11 ' A' ' 26' ' ' LEU . 32.8 m170 -31.73 121.49 0.27 Allowed 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 112.764 -2.017 . . . . 0.0 113.28 -176.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.575 ' OG1' ' HB2' ' A' ' 64' ' ' SER . 6.9 p -111.08 -13.64 14.02 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 113.999 -1.455 . . . . 0.0 110.568 -179.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.86 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -164.18 135.26 4.42 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.458 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.637 ' HB3' ' HB2' ' A' ' 60' ' ' CYS . 0.5 OUTLIER -114.03 127.1 55.79 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.474 -0.49 . . . . 0.0 112.23 -178.765 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.494 ' CG ' ' O ' ' A' ' 83' ' ' HIS . 1.7 p80 -122.49 116.56 24.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.934 178.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 60' ' ' CYS . 31.6 p -69.62 146.73 51.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.082 0.468 . . . . 0.0 111.478 -179.131 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.444 ' OG ' ' N ' ' A' ' 86' ' ' THR . 0.1 OUTLIER -179.78 177.04 0.72 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.853 -179.866 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.444 ' N ' ' OG ' ' A' ' 85' ' ' SER . 4.2 t -34.63 135.66 0.17 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.141 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 3.9 m -115.11 -170.69 1.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.602 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.489 ' O ' ' O ' ' A' ' 89' ' ' TYR . 0.1 OUTLIER 40.4 48.22 2.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.595 179.892 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.543 ' CD1' ' N ' ' A' ' 89' ' ' TYR . 0.0 OUTLIER -36.91 163.28 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.118 -179.71 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.407 ' C ' ' HG3' ' A' ' 91' ' ' LYS . 0.3 OUTLIER -129.99 64.97 1.51 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.888 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.407 ' HG3' ' C ' ' A' ' 90' ' ' HIS . 0.1 OUTLIER 71.08 -71.12 0.14 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.981 179.947 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.843 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.698 ' C8 ' ' CB ' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.617 ' H3 ' ' O7 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . 0.675 ' C4 ' ' H1 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . 0.675 ' H1 ' ' C4 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.643 ' H4 ' ' O2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . 0.643 ' O2 ' ' H4 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.854 0.359 . . . . 0.0 111.077 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.538 ' O ' ' CB ' ' A' ' 3' ' ' ASP . 19.0 Cg_endo -57.91 -168.43 0.03 OUTLIER 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.703 2.268 . . . . 0.0 111.851 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.538 ' CB ' ' O ' ' A' ' 2' ' ' PRO . 0.3 OUTLIER 85.47 -17.44 0.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.179 179.931 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 t -70.81 -138.79 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.945 179.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.431 HE21 ' HB3' ' A' ' 5' ' ' GLN . 0.9 OUTLIER -139.41 23.28 2.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.839 0.352 . . . . 0.0 111.228 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.7 t70 179.99 155.02 0.58 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.677 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -179.57 83.18 0.2 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.822 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -85.11 59.34 5.34 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 123.116 2.544 . . . . 0.0 113.046 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.465 ' HA ' ' O ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER 72.75 172.62 0.3 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.963 0.411 . . . . 0.0 111.424 179.386 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.654 ' HB2' ' HA3' ' A' ' 30' ' ' GLY . 0.1 OUTLIER -95.46 145.64 25.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.843 179.849 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.629 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 0.3 OUTLIER 157.66 164.92 0.01 OUTLIER 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.339 0.59 . . . . 0.0 111.973 178.946 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.788 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER -67.59 113.33 5.32 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.997 -1.002 . . . . 0.0 109.602 178.205 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.595 ' O ' ' C ' ' A' ' 14' ' ' GLU . 1.3 mm-40 -101.77 52.75 0.82 Allowed 'General case' 0 CA--C 1.499 -0.997 0 CA-C-O 122.119 0.962 . . . . 0.0 110.527 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.595 ' C ' ' O ' ' A' ' 13' ' ' GLN . 4.7 tt0 -4.47 118.0 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 112.761 -2.018 . . . . 0.0 110.845 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.686 ' ND2' HG13 ' A' ' 76' ' ' VAL . 0.4 OUTLIER -54.63 102.54 0.31 Allowed Pre-proline 0 C--N 1.302 -1.489 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.382 -178.787 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.472 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 1.4 Cg_endo -76.65 1.33 8.62 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.223 1.949 . . . . 0.0 109.046 177.349 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.622 ' CE1' ' HE3' ' A' ' 71' ' ' MET . 1.1 t80 -93.51 -53.64 3.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 113.518 -1.674 . . . . 0.0 110.08 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.736 ' CD2' HG23 ' A' ' 70' ' ' VAL . 4.0 m-85 -87.5 -4.98 58.99 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.63 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.619 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.7 OUTLIER -48.46 97.36 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.346 179.402 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.62 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -101.23 158.28 32.09 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.667 -179.511 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.425 ' CD ' ' HG3' ' A' ' 20' ' ' GLN . 32.5 Cg_exo -57.98 65.76 0.05 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.582 2.188 . . . . 0.0 111.044 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.62 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 134.66 1.06 3.49 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.168 -179.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.516 ' CB ' ' H82' ' A' ' 178' ' ' NAG . . . -150.82 99.99 3.1 Favored Pre-proline 0 CA--C 1.512 -0.519 0 CA-C-O 122.022 0.915 . . . . 0.0 111.424 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.64 ' O ' ' O ' ' A' ' 25' ' ' ILE . 93.2 Cg_endo -103.23 78.87 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.414 0 C-N-CA 124.809 3.673 . . . . 0.0 113.318 -178.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.838 ' CG2' ' H ' ' A' ' 26' ' ' LEU . 15.3 mm -40.45 -177.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.838 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -150.75 -162.76 1.62 Allowed 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 122.413 1.102 . . . . 0.0 113.662 -175.856 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.531 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 7.5 tp-100 166.92 59.76 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 112.918 -1.947 . . . . 0.0 111.104 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.629 ' HA ' ' O ' ' A' ' 11' ' ' THR . 7.4 t -28.2 99.71 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.975 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.571 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 8.2 tpt -61.44 164.11 6.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.206 178.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.654 ' HA3' ' HB2' ' A' ' 10' ' ' CYS . . . -132.81 101.36 0.44 Allowed Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.184 -1.008 . . . . 0.0 113.131 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.465 ' O ' ' HA ' ' A' ' 9' ' ' GLU . 1.8 m -158.53 52.59 0.42 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.847 0.356 . . . . 0.0 110.73 179.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.662 ' O ' ' CB ' ' A' ' 33' ' ' PHE . 0.7 OUTLIER -41.66 -74.9 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.714 -179.967 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.662 ' CB ' ' O ' ' A' ' 32' ' ' CYS . 16.5 m-85 114.33 5.63 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.043 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.481 ' O ' ' O ' ' A' ' 33' ' ' PHE . 0.3 OUTLIER 57.32 127.4 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.804 179.864 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.425 ' O ' ' HG3' ' A' ' 35' ' ' ARG . 11.8 ptt-85 -128.67 16.58 6.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.824 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -145.48 138.46 26.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.453 -179.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.551 ' CB ' ' HD3' ' A' ' 38' ' ' PRO . 0.2 OUTLIER 179.92 -54.34 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.263 179.679 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.551 ' HD3' ' CB ' ' A' ' 37' ' ' TYR . 1.0 OUTLIER -83.11 156.63 15.02 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 123.372 2.715 . . . . 0.0 112.082 179.696 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.673 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -133.91 37.02 0.35 Allowed Pre-proline 0 C--N 1.327 -0.386 0 CA-C-O 120.987 0.422 . . . . 0.0 110.978 179.817 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.673 ' CD ' ' N ' ' A' ' 39' ' ' THR . 60.5 Cg_endo -72.49 50.77 1.7 Allowed 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.643 2.229 . . . . 0.0 112.171 179.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.441 HD11 ' C ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -164.01 50.54 0.13 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.007 -179.628 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 65.6 -124.52 0.35 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.653 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 61.41 -152.07 0.38 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.737 0.303 . . . . 0.0 110.887 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.466 ' HG2' ' N ' ' A' ' 45' ' ' LYS . 32.7 ttmt -164.99 154.32 12.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.759 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.466 ' N ' ' HG2' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -163.72 153.66 15.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.008 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.419 ' CG2' ' N ' ' A' ' 47' ' ' MET . 7.3 t -161.63 -145.48 0.11 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.595 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.419 ' N ' ' CG2' ' A' ' 46' ' ' THR . 3.9 mtt -89.68 27.7 1.46 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.946 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.402 ' C ' ' O ' ' A' ' 47' ' ' MET . 0.8 OUTLIER 38.05 68.29 0.33 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.711 -179.927 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -102.06 168.37 2.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.229 -179.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.539 ' O ' ' CB ' ' A' ' 51' ' ' LYS . 5.3 mm-40 49.06 20.01 0.34 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.204 179.685 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.539 ' CB ' ' O ' ' A' ' 50' ' ' GLN . 0.7 OUTLIER 156.74 117.13 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.789 0.328 . . . . 0.0 111.092 179.991 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 20.9 t30 -141.47 111.65 6.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.531 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -134.43 13.78 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.63 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 13.9 t -168.66 121.14 0.81 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.149 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 5.7 m -144.0 -168.94 2.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.7 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.5 ' O ' ' CB ' ' A' ' 57' ' ' SER . 2.4 pt-20 -71.51 117.8 13.53 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.081 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 56' ' ' GLU . 0.4 OUTLIER 160.56 154.03 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.52 179.98 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.627 ' O ' ' CB ' ' A' ' 59' ' ' CYS . 65.0 p -150.26 179.35 8.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.275 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.627 ' CB ' ' O ' ' A' ' 58' ' ' THR . 4.5 m 138.62 122.06 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.353 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 62.7 m -105.81 67.86 0.77 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.419 -179.444 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.606 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -80.94 70.79 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.349 179.394 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.606 ' O ' ' O ' ' A' ' 61' ' ' VAL . . . 21.12 111.56 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.435 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.639 ' N ' ' O ' ' A' ' 81' ' ' ALA . 2.5 ttmt -52.04 -36.76 51.33 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 178.223 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.517 ' N ' ' HB2' ' A' ' 81' ' ' ALA . 3.5 m -136.09 178.02 7.38 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.273 -1.331 . . . . 0.0 108.863 179.116 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.707 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 2.7 p90 -158.27 157.09 31.85 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.085 -0.646 . . . . 0.0 112.572 -179.639 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.891 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 0.4 OUTLIER -127.42 24.99 6.17 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-O 122.705 1.24 . . . . 0.0 107.989 176.501 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.665 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 3.3 ptt85 -2.87 120.05 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 112.144 -2.298 . . . . 0.0 112.198 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.748 HG23 ' CD1' ' A' ' 25' ' ' ILE . 2.5 m -124.42 45.23 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.504 179.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.61 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 94.5 m -20.12 119.55 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 121.17 0.509 . . . . 0.0 110.747 -178.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.736 HG23 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -122.88 -164.02 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.005 -179.169 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.622 ' HE3' ' CE1' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -28.3 138.72 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.45 -1.25 . . . . 0.0 111.323 -179.583 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 57.04 11.94 6.68 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.005 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.53 ' N ' ' O ' ' A' ' 70' ' ' VAL . . . 74.96 39.29 38.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.141 -179.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.61 ' O ' ' HA ' ' A' ' 69' ' ' THR . 12.9 m-85 -73.48 114.51 11.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.95 0.405 . . . . 0.0 111.219 -179.616 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.417 ' C ' ' H ' ' A' ' 77' ' ' GLU . 4.7 mtmm -95.57 95.81 8.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.734 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.769 ' CG2' ' CG2' ' A' ' 25' ' ' ILE . 26.8 m -83.59 10.7 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.35 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.707 ' O ' ' CB ' ' A' ' 65' ' ' TYR . 0.3 OUTLIER 28.15 40.44 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 -177.145 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.891 ' HB3' ' CA ' ' A' ' 66' ' ' ASN . 9.9 t-20 8.96 63.17 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.991 0 CA-C-N 113.932 -1.485 . . . . 0.0 107.42 -175.627 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.788 ' O ' ' CD2' ' A' ' 12' ' ' LEU . 28.5 m170 -37.76 99.8 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.233 0 CA-C-O 122.498 1.142 . . . . 0.0 111.781 -175.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.696 HG21 ' OD1' ' A' ' 78' ' ' ASN . 10.2 p -95.9 0.25 51.76 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 113.781 -1.554 . . . . 0.0 111.347 -178.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.639 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -167.8 146.81 4.78 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.038 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 84.2 m -120.4 170.19 9.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.827 0.346 . . . . 0.0 111.428 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.541 ' O ' ' HA ' ' A' ' 60' ' ' CYS . 0.3 OUTLIER -175.27 108.91 0.1 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.936 179.717 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.52 ' HB2' ' SG ' ' A' ' 60' ' ' CYS . 3.2 t -82.48 114.0 20.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.914 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.519 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 0.1 OUTLIER 160.69 179.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.001 0.429 . . . . 0.0 111.391 179.64 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.5 ' O ' ' HB3' ' A' ' 87' ' ' CYS . 0.2 OUTLIER 39.66 -146.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.303 179.886 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.5 ' HB3' ' O ' ' A' ' 86' ' ' THR . 0.0 OUTLIER 77.42 136.13 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.608 -179.728 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 49.42 -141.62 0.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.488 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -155.1 -77.96 0.1 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.681 0.277 . . . . 0.0 111.297 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.504 ' CE1' ' OG ' ' A' ' 92' ' ' SER . 1.9 t60 59.38 100.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.954 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.413 ' C ' ' OG ' ' A' ' 92' ' ' SER . 0.0 OUTLIER -101.77 141.24 34.92 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.111 -179.829 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.504 ' OG ' ' CE1' ' A' ' 90' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.145 -0.931 . . . . 0.0 110.991 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.738 ' C6 ' ' H1 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.748 ' O7 ' ' C3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.688 ' H5 ' ' O5 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . 0.688 ' O5 ' ' H5 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.626 ' CB ' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.488 1.433 0 CA-C-O 120.625 0.25 . . . . 0.0 111.204 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.626 ' CD ' ' CB ' ' A' ' 1' ' ' ALA . 10.2 Cg_endo -50.11 -34.93 40.51 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.77 2.314 . . . . 0.0 111.808 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -80.96 -41.02 23.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.728 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.514 ' O ' ' CB ' ' A' ' 5' ' ' GLN . 5.5 p -145.79 140.56 21.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.969 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.514 ' CB ' ' O ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER 83.37 57.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.691 -179.891 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.489 ' OD1' ' N ' ' A' ' 6' ' ' ASP . 11.6 p-10 -165.14 25.68 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.196 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.515 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 20.5 p -171.0 78.89 0.54 Allowed Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.797 179.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -64.44 67.98 0.24 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.626 2.217 . . . . 0.0 112.469 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.52 ' OE1' ' CE1' ' A' ' 33' ' ' PHE . 0.6 OUTLIER 57.16 -177.61 0.06 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.279 179.782 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 88.8 m -71.72 131.82 43.67 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.499 -179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.778 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 0.0 OUTLIER -161.59 -131.46 0.02 OUTLIER 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.061 179.625 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.809 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 8.5 mp -145.74 127.04 14.86 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.865 0.364 . . . . 0.0 111.348 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.585 ' O ' ' C ' ' A' ' 14' ' ' GLU . 2.9 mm-40 -92.81 46.6 1.24 Allowed 'General case' 0 CA--C 1.504 -0.813 0 CA-C-O 121.799 0.809 . . . . 0.0 110.397 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.602 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 4.1 tt0 -0.59 117.63 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 113.522 -1.672 . . . . 0.0 111.419 -178.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.756 ' HB2' HG23 ' A' ' 25' ' ' ILE . 1.2 t-20 -58.76 103.93 0.39 Allowed Pre-proline 0 C--N 1.306 -1.288 0 CA-C-N 113.957 -1.474 . . . . 0.0 111.214 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.453 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 3.0 Cg_exo -74.27 14.85 0.68 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.914 2.409 . . . . 0.0 112.167 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.437 ' H ' ' C ' ' A' ' 15' ' ' ASN . 58.9 t80 -113.42 -50.84 2.84 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.415 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.849 ' HB3' ' CG1' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -79.82 -11.17 59.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.237 -179.549 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.609 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -52.36 104.36 0.09 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.63 -179.391 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.596 ' CG ' ' O ' ' A' ' 18' ' ' PHE . 0.9 OUTLIER -123.14 166.13 19.4 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.581 179.402 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.05 76.99 0.02 OUTLIER 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.703 2.269 . . . . 0.0 112.501 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 119.81 10.23 7.8 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.516 -0.849 . . . . 0.0 112.982 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.542 ' HB3' ' C8 ' ' A' ' 178' ' ' NAG . . . -161.38 98.1 1.28 Allowed Pre-proline 0 CA--C 1.512 -0.504 0 CA-C-O 122.141 0.972 . . . . 0.0 112.227 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.609 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 74.2 Cg_endo -106.55 82.45 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.549 1 C-N-CA 125.301 4.001 . . . . 0.0 111.958 -179.356 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.849 ' CG1' ' HB3' ' A' ' 18' ' ' PHE . 32.8 mm -42.01 -176.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.817 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -155.92 -156.97 0.68 Allowed 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 115.028 1.492 . . . . 0.0 115.028 -173.579 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.525 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 1.3 tp-100 160.78 72.19 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 112.637 -2.074 . . . . 0.0 110.575 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.811 ' SG ' ' HB3' ' A' ' 79' ' ' HIS . 73.8 m -21.39 114.15 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.86 -179.078 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.535 ' CE ' ' OE1' ' A' ' 13' ' ' GLN . 7.1 tpp -51.16 -39.69 56.94 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.482 ' O ' ' HB2' ' A' ' 31' ' ' CYS . . . 63.72 119.12 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.997 -0.621 . . . . 0.0 112.876 179.433 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 30' ' ' GLY . 24.6 t 176.44 72.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.86 0.362 . . . . 0.0 110.91 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.8 m -75.98 157.79 32.68 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.16 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.52 ' CE1' ' OE1' ' A' ' 9' ' ' GLU . 34.6 p90 179.15 133.19 0.09 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.14 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 26.7 m 55.78 -173.1 0.06 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.912 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.3 ttt180 -128.41 161.17 30.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.763 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.47 ' O ' ' CD1' ' A' ' 37' ' ' TYR . . . -139.93 63.01 1.5 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.16 0.505 . . . . 0.0 111.047 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.479 ' N ' ' CD ' ' A' ' 38' ' ' PRO . 0.3 OUTLIER -153.01 50.14 0.57 Allowed Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.811 -179.875 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.479 ' CD ' ' N ' ' A' ' 37' ' ' TYR . 7.2 Cg_exo -35.97 130.37 0.35 Allowed 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.359 2.706 . . . . 0.0 112.511 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.472 ' O ' ' O ' ' A' ' 38' ' ' PRO . 11.5 p 54.81 154.61 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.132 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_exo -61.66 160.69 27.48 Favored 'Trans proline' 0 C--O 1.231 0.132 0 C-N-CA 122.94 2.427 . . . . 0.0 112.493 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.445 ' O ' ' CB ' ' A' ' 42' ' ' ARG . 37.9 mt -122.61 -137.29 0.31 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.747 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.466 ' O ' ' HB3' ' A' ' 43' ' ' SER . 0.2 OUTLIER 165.59 79.01 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.889 0.376 . . . . 0.0 111.034 179.929 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.466 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 9.2 p 163.94 94.98 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.818 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 52.2 102.27 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.847 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.471 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 0.2 OUTLIER -69.25 -166.12 0.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.704 179.815 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.411 ' O ' ' C ' ' A' ' 47' ' ' MET . 11.0 p -96.34 147.35 23.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.862 0.363 . . . . 0.0 111.07 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.411 ' C ' ' O ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -36.56 142.55 0.09 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.14 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 65.8 mt -125.56 166.92 15.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.312 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.517 HG11 ' N ' ' A' ' 50' ' ' GLN . 0.9 OUTLIER -51.57 162.55 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.867 -179.915 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.517 ' N ' HG11 ' A' ' 49' ' ' VAL . 4.4 pm0 -101.31 48.85 0.88 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.734 -179.211 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.601 ' O ' ' ND2' ' A' ' 52' ' ' ASN . 0.0 OUTLIER 73.55 84.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.677 179.107 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.601 ' ND2' ' O ' ' A' ' 51' ' ' LYS . 0.7 OUTLIER 150.89 133.08 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.84 0.353 . . . . 0.0 111.38 179.153 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.0 m -135.25 88.38 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.867 179.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.482 ' O ' ' HB3' ' A' ' 55' ' ' SER . 15.4 p -140.92 158.16 44.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.905 0.383 . . . . 0.0 111.063 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.482 ' HB3' ' O ' ' A' ' 54' ' ' THR . 21.3 t 75.12 166.74 0.28 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.245 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.486 ' O ' ' O ' ' A' ' 57' ' ' SER . 0.0 OUTLIER -123.96 -161.21 0.97 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.621 179.768 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.486 ' O ' ' O ' ' A' ' 56' ' ' GLU . 25.6 t 54.97 116.72 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.462 -179.712 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.463 ' C ' ' SG ' ' A' ' 59' ' ' CYS . 0.7 OUTLIER -85.64 139.47 31.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.08 0.467 . . . . 0.0 111.825 -179.145 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.493 ' O ' ' O ' ' A' ' 85' ' ' SER . 0.8 OUTLIER -161.79 128.76 3.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.087 179.25 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 1.2 m -70.36 123.25 21.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.859 0.362 . . . . 0.0 111.639 -179.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.56 ' CG1' ' O ' ' A' ' 61' ' ' VAL . 40.5 t -123.41 63.64 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.675 179.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.545 ' HA ' ' HA ' ' A' ' 82' ' ' CYS . . . 32.33 105.59 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.515 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.777 ' N ' ' O ' ' A' ' 81' ' ' ALA . 23.1 tptt -54.49 -42.14 70.4 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.704 0.764 . . . . 0.0 108.946 177.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.579 ' O ' ' N ' ' A' ' 80' ' ' THR . 50.0 m -141.94 123.28 14.82 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.577 179.212 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.735 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 0.4 OUTLIER -114.14 158.86 20.73 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.639 0.733 . . . . 0.0 112.93 -177.81 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.922 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -128.55 30.35 5.16 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 176.466 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.658 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -7.6 133.49 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 112.17 -2.286 . . . . 0.0 112.401 -179.35 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.753 HG22 HG13 ' A' ' 25' ' ' ILE . 2.4 m -139.47 45.17 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.87 -179.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.654 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 21.8 m -10.75 119.18 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.649 -179.368 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.753 ' CG1' ' CD1' ' A' ' 18' ' ' PHE . 4.6 m -120.61 -169.81 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.787 0.804 . . . . 0.0 112.635 -178.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.596 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 11.1 mtt 37.12 -125.44 0.19 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.304 -1.317 . . . . 0.0 111.087 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -87.74 36.51 3.35 Favored Glycine 0 N--CA 1.437 -1.29 0 CA-C-N 115.399 -0.819 . . . . 0.0 112.682 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.521 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 104.33 21.27 9.5 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.118 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.654 ' HB2' ' CG2' ' A' ' 70' ' ' VAL . 3.8 m-85 -52.15 -177.84 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.607 0.241 . . . . 0.0 111.01 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.568 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -154.34 106.39 2.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 179.753 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.817 ' CG2' ' CG2' ' A' ' 25' ' ' ILE . 22.8 m -104.95 12.49 8.14 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.368 0 CA-C-O 121.043 0.449 . . . . 0.0 110.477 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.735 ' O ' ' CB ' ' A' ' 65' ' ' TYR . 0.4 OUTLIER 23.7 43.88 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 -178.282 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.922 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 15.6 t-20 8.2 64.74 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.967 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 -175.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.811 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 26.5 m170 -41.36 90.61 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 122.362 1.077 . . . . 0.0 112.437 -175.412 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.595 HG21 ' OD1' ' A' ' 78' ' ' ASN . 4.2 p -83.29 -4.32 58.32 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 113.946 -1.479 . . . . 0.0 110.146 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.777 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -176.23 141.04 0.42 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.616 ' SG ' ' O ' ' A' ' 11' ' ' THR . 1.5 m -114.87 151.68 33.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.825 0.345 . . . . 0.0 110.95 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.615 ' O ' ' CD2' ' A' ' 83' ' ' HIS . 0.3 OUTLIER -152.48 119.44 5.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.936 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.51 ' O ' ' O ' ' A' ' 83' ' ' HIS . 36.1 m -46.13 -177.7 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.181 -179.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.522 ' O ' ' CB ' ' A' ' 86' ' ' THR . 5.2 p 55.48 162.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.703 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.534 ' O ' ' CG2' ' A' ' 61' ' ' VAL . 4.6 m 84.24 100.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.346 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.471 ' HB3' ' HB2' ' A' ' 59' ' ' CYS . 9.8 p 178.05 42.62 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.874 -179.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.509 ' O ' ' CD2' ' A' ' 89' ' ' TYR . 0.1 OUTLIER -170.38 -159.73 0.2 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.828 -179.996 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.509 ' CD2' ' O ' ' A' ' 88' ' ' TYR . 0.5 OUTLIER 167.59 34.27 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.496 179.677 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -110.23 177.09 4.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.634 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.439 ' O ' ' OXT' ' A' ' 92' ' ' SER . 5.4 tttp -168.61 -131.02 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.575 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.439 ' OXT' ' O ' ' A' ' 91' ' ' LYS . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.76 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.583 ' C6 ' ' H1 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.764 ' O7 ' ' C3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . 0.406 ' HO2' ' H5 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . 0.406 ' H5 ' ' HO2' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.752 ' C3 ' ' O7 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.573 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . 0.573 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.535 ' N ' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.843 0.354 . . . . 0.0 111.038 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.535 ' CD ' ' N ' ' A' ' 1' ' ' ALA . 72.7 Cg_endo -84.15 -62.1 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.849 2.366 . . . . 0.0 112.619 -179.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.48 ' OD1' ' HG2' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -119.7 -173.75 2.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.863 0.363 . . . . 0.0 111.104 -179.803 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.623 ' O ' ' CB ' ' A' ' 5' ' ' GLN . 3.0 p 165.42 99.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.626 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.623 ' CB ' ' O ' ' A' ' 4' ' ' VAL . 25.8 tt0 98.46 75.52 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.741 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -150.27 157.97 43.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.659 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.427 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 3.5 p 176.77 138.17 0.21 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.144 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 7' ' ' CYS . 6.2 Cg_exo -76.75 76.23 4.15 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 123.038 2.492 . . . . 0.0 111.888 179.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.509 ' HA ' ' O ' ' A' ' 31' ' ' CYS . 4.8 tt0 60.78 150.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.613 -179.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.571 ' CB ' ' HA3' ' A' ' 30' ' ' GLY . 28.1 p -30.98 123.94 0.21 Allowed 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.407 179.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.655 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 0.2 OUTLIER -154.47 164.41 38.7 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.457 0.646 . . . . 0.0 111.886 -179.895 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.781 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER -67.82 120.31 13.93 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.139 178.553 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.647 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.1 mt-30 -111.0 56.48 0.63 Allowed 'General case' 0 CA--C 1.501 -0.929 0 CA-C-O 122.015 0.912 . . . . 0.0 110.814 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.647 ' O ' ' O ' ' A' ' 13' ' ' GLN . 23.8 tt0 2.91 121.49 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 112.703 -2.044 . . . . 0.0 111.194 -179.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.866 ' ND2' HG13 ' A' ' 76' ' ' VAL . 0.4 OUTLIER -48.91 99.23 0.21 Allowed Pre-proline 0 C--N 1.306 -1.318 0 CA-C-N 114.455 -1.248 . . . . 0.0 111.697 -179.289 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.588 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 40.4 Cg_endo -66.51 5.0 0.81 Allowed 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 121.88 1.72 . . . . 0.0 109.765 178.031 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.612 ' CZ ' ' SD ' ' A' ' 71' ' ' MET . 0.6 OUTLIER -103.65 -56.93 2.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 113.883 -1.508 . . . . 0.0 110.514 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.793 ' CD2' HG22 ' A' ' 70' ' ' VAL . 0.6 OUTLIER -87.63 -2.33 58.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.007 -179.666 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.723 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.3 m -60.0 86.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.645 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.631 ' O ' ' N ' ' A' ' 22' ' ' GLY . 3.4 pt20 -108.67 154.37 41.72 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.788 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -57.14 66.74 0.04 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.23 0 C-N-CA 122.563 2.175 . . . . 0.0 111.232 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.631 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 149.56 -15.36 1.09 Allowed Glycine 0 N--CA 1.449 -0.438 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.681 -179.031 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.445 ' O ' ' O ' ' A' ' 18' ' ' PHE . . . -148.21 99.39 3.68 Favored Pre-proline 0 CA--C 1.51 -0.576 0 CA-C-O 122.007 0.908 . . . . 0.0 110.822 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.723 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 62.5 Cg_endo -104.57 66.36 0.02 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.692 0 C-N-CA 124.718 3.612 . . . . 0.0 113.755 -178.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.804 HG21 HG22 ' A' ' 76' ' ' VAL . 15.4 mm -39.75 -179.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 N-CA-C 112.789 0.662 . . . . 0.0 112.789 179.174 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.795 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -148.52 -163.01 1.68 Allowed 'General case' 0 CA--C 1.497 -1.078 0 CA-C-O 122.624 1.202 . . . . 0.0 113.992 -176.073 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.572 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 8.6 tp60 167.77 62.66 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 112.501 -2.136 . . . . 0.0 111.005 179.439 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.655 ' HA ' ' O ' ' A' ' 11' ' ' THR . 1.2 t -28.74 99.72 0.02 OUTLIER 'General case' 0 C--O 1.23 0.075 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.065 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.538 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 19.0 tpp -58.24 -117.49 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.037 -179.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.571 ' HA3' ' CB ' ' A' ' 10' ' ' CYS . . . 172.54 121.45 0.6 Allowed Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.35 -0.929 . . . . 0.0 112.796 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.509 ' O ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -152.74 49.31 0.74 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.168 0.509 . . . . 0.0 110.467 179.593 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.74 112.07 7.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.73 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.451 ' HB2' ' H ' ' A' ' 34' ' ' SER . 2.6 p90 -102.36 -139.45 0.35 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.003 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.451 ' H ' ' HB2' ' A' ' 33' ' ' PHE . 95.3 p -71.4 -176.9 1.63 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.973 0.416 . . . . 0.0 111.488 -179.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.464 ' CB ' ' CZ ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -127.2 -162.78 1.19 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.887 -179.923 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 64.65 107.97 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.878 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.404 ' HA ' ' HD2' ' A' ' 38' ' ' PRO . 3.4 m-30 -83.94 120.48 74.98 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.998 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 37' ' ' TYR . 11.7 Cg_endo -55.79 111.84 0.88 Allowed 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.649 2.233 . . . . 0.0 111.923 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.583 ' CG2' ' HD2' ' A' ' 40' ' ' PRO . 23.3 m -116.16 143.91 31.9 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.796 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.583 ' HD2' ' CG2' ' A' ' 39' ' ' THR . 49.1 Cg_exo -34.66 140.31 0.09 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.692 2.262 . . . . 0.0 112.429 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.551 ' O ' ' O ' ' A' ' 42' ' ' ARG . 1.5 mp 82.63 -54.46 0.2 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.788 -179.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.551 ' O ' ' O ' ' A' ' 41' ' ' LEU . 15.7 ptt180 52.23 125.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.166 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -134.54 132.35 39.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.951 -179.743 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.58 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -85.67 80.12 9.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.908 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 3.0 ttmp? -84.67 69.78 10.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.0 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.62 ' O ' ' CB ' ' A' ' 47' ' ' MET . 15.4 t -89.78 -161.29 0.77 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.921 0.391 . . . . 0.0 111.065 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.626 ' O ' ' CB ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER 145.0 -36.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.876 -179.731 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.626 ' CB ' ' O ' ' A' ' 47' ' ' MET . 0.1 OUTLIER 142.45 -167.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.875 179.97 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.8 t 68.17 142.61 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.679 0.276 . . . . 0.0 110.659 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -175.46 66.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.784 0.326 . . . . 0.0 111.229 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -113.98 37.81 3.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.824 179.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.491 ' O ' ' CG ' ' A' ' 52' ' ' ASN . 8.4 t-20 -84.94 15.35 4.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.81 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.446 ' O ' ' C ' ' A' ' 54' ' ' THR . 0.6 OUTLIER -170.48 134.21 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.954 179.949 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.499 HG22 HG21 ' A' ' 86' ' ' THR . 0.2 OUTLIER -34.65 -64.52 0.25 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.035 -179.863 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -157.82 175.72 13.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.002 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -75.83 76.79 2.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.778 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.23 63.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.799 179.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.42 HG23 ' HA ' ' A' ' 85' ' ' SER . 0.6 OUTLIER -86.74 143.76 27.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.913 179.946 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.8 p -147.08 134.75 21.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.957 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.511 ' SG ' ' CB ' ' A' ' 84' ' ' CYS . 83.8 m -88.81 125.05 34.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.315 -179.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.549 ' O ' ' O ' ' A' ' 62' ' ' ALA . 11.4 p -126.43 71.12 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.047 179.43 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.549 ' O ' ' O ' ' A' ' 61' ' ' VAL . . . 24.54 106.88 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.456 -179.344 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.804 ' N ' ' O ' ' A' ' 81' ' ' ALA . 9.7 ttmm -55.25 -42.66 73.78 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 177.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.477 ' HB2' ' OG1' ' A' ' 80' ' ' THR . 0.7 OUTLIER -136.9 136.81 38.98 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.251 -1.341 . . . . 0.0 108.901 178.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.692 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 6.2 p90 -126.2 160.94 28.87 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.141 0.496 . . . . 0.0 112.264 -178.045 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.86 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 1.2 t30 -126.08 27.03 6.39 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-O 122.51 1.148 . . . . 0.0 107.945 176.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.576 ' HG3' ' HA ' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -9.57 122.94 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 112.466 -2.152 . . . . 0.0 111.367 -179.46 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.73 ' O ' HG21 ' A' ' 68' ' ' VAL . 2.4 m -119.47 40.81 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.186 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.694 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 48.0 m -18.08 118.39 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.282 -179.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.793 HG22 ' CD2' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -131.76 -167.37 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-O 121.608 0.718 . . . . 0.0 112.215 -178.544 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.612 ' SD ' ' CZ ' ' A' ' 17' ' ' PHE . 0.0 OUTLIER 42.32 -131.57 0.53 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.755 -179.839 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -83.7 36.5 2.82 Favored Glycine 0 N--CA 1.435 -1.394 0 CA-C-N 115.263 -0.881 . . . . 0.0 112.099 179.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 94.55 47.0 2.84 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.034 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.694 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.5 m-85 -78.28 178.53 7.57 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.662 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -155.59 110.18 2.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.984 0.421 . . . . 0.0 111.669 -179.876 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.866 HG13 ' ND2' ' A' ' 15' ' ' ASN . 10.1 m -107.5 10.59 9.12 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.416 0 CA-C-O 121.288 0.566 . . . . 0.0 109.686 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.772 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER 28.54 40.12 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 -177.601 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.86 ' HB3' ' CA ' ' A' ' 66' ' ' ASN . 13.9 t-20 5.95 62.26 0.0 OUTLIER 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 -176.105 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.781 ' O ' ' CD2' ' A' ' 12' ' ' LEU . 28.4 m170 -37.17 103.67 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.252 0 CA-C-O 122.409 1.1 . . . . 0.0 112.026 -175.239 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.649 ' CG2' ' O ' ' A' ' 78' ' ' ASN . 7.8 p -102.44 -5.58 23.92 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 113.777 -1.556 . . . . 0.0 111.32 -178.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.804 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -167.2 135.34 2.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.489 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 15.6 m -115.84 155.14 28.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.832 0.349 . . . . 0.0 111.095 -179.109 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.566 ' O ' ' CD2' ' A' ' 83' ' ' HIS . 0.2 OUTLIER -159.78 116.76 2.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.964 0.411 . . . . 0.0 111.075 179.534 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.511 ' CB ' ' SG ' ' A' ' 60' ' ' CYS . 0.5 OUTLIER -73.48 137.72 44.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.972 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.561 ' OG ' ' N ' ' A' ' 86' ' ' THR . 17.0 t 163.99 -165.78 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.979 179.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.561 ' N ' ' OG ' ' A' ' 85' ' ' SER . 25.1 p -49.65 -178.79 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.064 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 52.6 m -154.12 92.66 1.55 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.687 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -113.79 132.99 55.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.891 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.449 ' O ' ' HB2' ' A' ' 90' ' ' HIS . 0.4 OUTLIER -153.47 -76.16 0.12 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.928 179.804 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.449 ' HB2' ' O ' ' A' ' 89' ' ' TYR . 66.3 t-80 178.69 158.85 0.54 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.163 -179.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -95.4 127.59 41.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.993 -179.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.7 t . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.19 -0.91 . . . . 0.0 110.999 180.0 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.554 ' O4 ' ' O7 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.554 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . 0.673 ' O2 ' ' H5 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . 0.673 ' H5 ' ' O2 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.831 ' H3 ' ' O7 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.611 ' H5 ' ' O5 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . 0.611 ' O5 ' ' H5 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . 0.575 ' H1 ' ' H62' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.547 ' CB ' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.937 0.398 . . . . 0.0 110.996 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.547 ' CD ' ' CB ' ' A' ' 1' ' ' ALA . 14.9 Cg_exo -35.13 134.51 0.18 Allowed 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 123.217 2.611 . . . . 0.0 112.359 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -106.8 -53.97 2.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.936 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.418 ' C ' ' HG2' ' A' ' 5' ' ' GLN . 0.5 OUTLIER -74.89 151.72 6.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.88 0.371 . . . . 0.0 111.07 179.958 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.418 ' HG2' ' C ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -138.15 -155.05 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.964 -179.594 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.519 ' OD1' ' N ' ' A' ' 6' ' ' ASP . 0.3 OUTLIER -55.42 -170.4 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.688 179.89 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.429 ' C ' ' SG ' ' A' ' 31' ' ' CYS . 12.2 t -178.75 76.28 0.21 Allowed Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.859 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.437 ' HG2' ' HA3' ' A' ' 30' ' ' GLY . 70.2 Cg_endo -74.45 158.76 43.98 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.643 2.229 . . . . 0.0 112.467 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.465 ' HA ' ' CE1' ' A' ' 33' ' ' PHE . 0.3 OUTLIER -49.36 124.33 9.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.888 179.947 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.537 ' HB2' ' C ' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -58.88 126.62 28.42 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.058 -179.901 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.648 ' O ' ' N ' ' A' ' 29' ' ' MET . 9.2 t 176.29 -175.04 0.11 Allowed 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.098 179.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.699 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 4.6 mp -79.76 136.72 36.82 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.554 -179.532 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.629 ' O ' ' O ' ' A' ' 14' ' ' GLU . 42.9 mt-30 -115.39 60.53 0.7 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.212 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.629 ' O ' ' O ' ' A' ' 13' ' ' GLN . 20.9 tt0 2.8 121.2 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.752 -179.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.7 ' HB2' HG23 ' A' ' 25' ' ' ILE . 1.5 t-20 -51.71 113.07 3.67 Favored Pre-proline 0 C--N 1.306 -1.311 0 CA-C-N 113.866 -1.515 . . . . 0.0 112.139 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_endo -79.86 18.16 1.18 Allowed 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.418 2.079 . . . . 0.0 111.607 178.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.574 ' CD2' ' SD ' ' A' ' 71' ' ' MET . 15.6 t80 -124.88 -55.28 1.61 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.487 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.787 ' CD1' ' CG1' ' A' ' 70' ' ' VAL . 0.2 OUTLIER -73.03 -16.17 61.5 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.829 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.481 ' HB3' ' O ' ' A' ' 15' ' ' ASN . 4.2 p -49.18 88.05 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.627 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.599 ' O ' ' N ' ' A' ' 22' ' ' GLY . 4.3 mt-30 -113.58 160.21 32.57 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.063 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.14 67.21 0.03 OUTLIER 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.757 2.304 . . . . 0.0 112.19 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.599 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 144.54 -5.45 1.58 Allowed Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.811 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.505 ' HB3' ' H82' ' A' ' 178' ' ' NAG . . . -153.46 105.32 2.56 Favored Pre-proline 0 CA--C 1.515 -0.376 0 CA-C-O 122.006 0.907 . . . . 0.0 111.858 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.672 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.4 Cg_endo -102.95 68.26 0.03 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.457 0 C-N-CA 124.904 3.736 . . . . 0.0 112.528 -179.332 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.855 ' CG2' ' H ' ' A' ' 26' ' ' LEU . 24.4 mm -39.82 -174.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -179.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.855 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -153.63 -159.21 0.95 Allowed 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -174.858 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.497 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 1.9 tt0 160.16 101.61 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 112.661 -2.063 . . . . 0.0 110.062 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.55 ' HB2' ' HD1' ' A' ' 79' ' ' HIS . 0.1 OUTLIER -47.11 103.71 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.115 -179.005 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.648 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.6 OUTLIER -120.23 140.77 50.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.935 179.726 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.437 ' HA3' ' HG2' ' A' ' 8' ' ' PRO . . . 134.38 -135.88 8.25 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.711 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.537 ' C ' ' HB2' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -158.87 136.29 10.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.795 0.331 . . . . 0.0 110.908 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 50.5 t -73.41 73.66 1.38 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.34 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.465 ' CE1' ' HA ' ' A' ' 9' ' ' GLU . 24.1 p90 -121.23 -173.9 2.72 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.62 179.599 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -173.85 148.96 1.49 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.896 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.3 mmt85 -40.96 131.83 2.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.775 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.485 ' O ' ' CB ' ' A' ' 37' ' ' TYR . . . -74.28 117.05 15.65 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.108 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.485 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 5.8 t80 161.87 123.4 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.738 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.453 ' O ' ' C ' ' A' ' 39' ' ' THR . 10.2 Cg_endo -53.42 170.69 0.35 Allowed 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.775 2.316 . . . . 0.0 112.098 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.453 ' C ' ' O ' ' A' ' 38' ' ' PRO . 81.7 p 33.84 64.77 1.51 Allowed Pre-proline 0 C--N 1.331 -0.214 0 CA-C-O 121.076 0.465 . . . . 0.0 110.524 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -71.82 173.52 12.58 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.86 2.373 . . . . 0.0 112.69 -179.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.456 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 4.0 mm? -61.92 121.25 12.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.918 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -151.25 72.58 1.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.98 -179.798 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 30.6 t -166.02 -94.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.633 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.506 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -54.88 104.83 0.13 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.142 179.409 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.486 ' HG2' HG23 ' A' ' 46' ' ' THR . 10.9 ttpt -179.88 -30.03 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.182 -179.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.486 HG23 ' HG2' ' A' ' 45' ' ' LYS . 0.2 OUTLIER 175.07 -35.39 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.729 -179.987 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -165.08 168.47 17.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.818 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.451 ' O ' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -85.77 79.67 9.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.814 0.34 . . . . 0.0 111.08 179.956 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.451 ' O ' ' O ' ' A' ' 48' ' ' LEU . 31.5 t 56.44 151.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.168 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.454 ' O ' ' C ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -129.53 156.42 44.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.707 179.88 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.454 ' C ' ' O ' ' A' ' 50' ' ' GLN . 0.2 OUTLIER -33.09 115.47 0.2 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.886 179.985 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -79.25 -167.42 1.18 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.506 ' O ' ' C ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -144.86 112.58 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.628 179.908 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.548 ' O ' ' CB ' ' A' ' 55' ' ' SER . 3.1 t -26.04 -58.94 0.08 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.414 -179.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.548 ' CB ' ' O ' ' A' ' 54' ' ' THR . 1.4 t 155.83 121.01 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.927 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.486 ' N ' ' OE1' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -150.58 83.73 1.36 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.806 179.869 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 62.74 -152.35 0.35 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.812 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.655 ' O ' ' CB ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER 179.4 -177.09 0.3 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.063 179.944 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.655 ' CB ' ' O ' ' A' ' 58' ' ' THR . 27.3 t 107.33 132.92 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.893 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.2 m -55.32 121.48 9.0 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.008 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.586 ' O ' ' C ' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -146.83 76.17 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.57 179.872 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.603 ' HA ' ' O ' ' A' ' 81' ' ' ALA . . . -5.71 102.73 0.01 OUTLIER 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 122.071 0.938 . . . . 0.0 112.317 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.824 ' HG3' ' C ' ' A' ' 81' ' ' ALA . 0.1 OUTLIER -50.8 -44.85 59.05 Favored 'General case' 0 CA--C 1.49 -1.33 0 CA-C-N 113.613 -1.63 . . . . 0.0 108.597 178.028 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.678 ' O ' ' N ' ' A' ' 80' ' ' THR . 37.2 m -138.96 112.48 8.25 Favored 'General case' 0 N--CA 1.425 -1.677 0 CA-C-N 113.625 -1.625 . . . . 0.0 110.395 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.696 ' CG ' ' CG ' ' A' ' 77' ' ' GLU . 0.9 OUTLIER -99.66 164.25 12.14 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.843 -178.823 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.782 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -134.65 29.16 3.56 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 177.317 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.595 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -6.18 129.98 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 112.099 -2.319 . . . . 0.0 112.487 -179.678 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.837 HG22 HG13 ' A' ' 25' ' ' ILE . 3.2 m -141.04 47.31 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.593 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.669 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 20.1 m -6.92 118.64 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.138 -179.075 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.787 ' CG1' ' CD1' ' A' ' 18' ' ' PHE . 5.4 m -119.01 -169.48 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.867 0.841 . . . . 0.0 112.851 -178.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.574 ' SD ' ' CD2' ' A' ' 17' ' ' PHE . 3.0 mmt 34.51 -127.86 0.09 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.212 -1.358 . . . . 0.0 111.517 179.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -83.02 35.81 2.73 Favored Glycine 0 N--CA 1.44 -1.06 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.585 -179.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.479 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 103.33 19.24 12.74 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.869 -0.682 . . . . 0.0 112.027 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.708 ' HB2' ' CG2' ' A' ' 70' ' ' VAL . 3.0 m-85 -52.03 -176.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.656 0.265 . . . . 0.0 111.038 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.566 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 18.9 mtmm -153.36 94.85 1.86 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.902 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.78 ' CG2' ' CG2' ' A' ' 25' ' ' ILE . 31.7 m -86.44 10.77 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.359 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.633 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.727 ' O ' ' HD2' ' A' ' 79' ' ' HIS . 0.1 OUTLIER 26.46 42.01 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 105.666 -1.975 . . . . 0.0 105.666 -177.632 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.782 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 51.6 t30 -0.86 69.98 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.846 0 CA-C-N 113.51 -1.677 . . . . 0.0 109.16 -174.209 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.727 ' HD2' ' O ' ' A' ' 77' ' ' GLU . 41.3 m170 -43.34 111.76 0.31 Allowed 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 113.472 -1.694 . . . . 0.0 113.5 -176.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.678 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.5 p -91.71 -33.58 14.98 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 113.731 -1.577 . . . . 0.0 108.413 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.824 ' C ' ' HG3' ' A' ' 63' ' ' LYS . . . -149.55 150.04 31.64 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 177.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.9 OUTLIER -129.35 130.41 46.04 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.075 0.464 . . . . 0.0 111.674 -179.612 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.611 ' HB3' ' HD2' ' A' ' 63' ' ' LYS . 0.4 OUTLIER -131.99 131.38 42.49 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.615 -179.718 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 66.6 m -65.24 102.07 0.62 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.222 178.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.559 ' N ' ' O ' ' A' ' 59' ' ' CYS . 0.7 OUTLIER -156.2 174.7 15.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.728 -179.616 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.437 ' C ' ' O ' ' A' ' 85' ' ' SER . 0.5 OUTLIER -33.93 129.12 0.35 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.153 -179.922 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.505 ' CB ' HG12 ' A' ' 61' ' ' VAL . 1.0 OUTLIER -146.41 161.92 39.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.855 -179.998 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -103.36 143.91 32.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.734 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 11.2 m-30 -69.76 57.5 0.14 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.861 0.362 . . . . 0.0 110.836 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.591 ' O ' ' C ' ' A' ' 91' ' ' LYS . 1.3 t-160 -109.01 -53.21 2.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.705 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.591 ' C ' ' O ' ' A' ' 90' ' ' HIS . 0.0 OUTLIER -1.44 72.86 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.908 179.938 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.541 ' N ' ' O ' ' A' ' 90' ' ' HIS . 16.8 m . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.769 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.647 ' H3 ' ' HD2' ' A' ' 24' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.757 ' O7 ' ' C3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . 0.601 ' H4 ' ' O5 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . 0.521 ' H3 ' ' O4 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . 0.601 ' O5 ' ' H4 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.733 ' C3 ' ' O7 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.698 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . 0.698 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . 0.403 ' O5 ' ' O3 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.892 0.377 . . . . 0.0 110.951 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -77.68 97.38 1.14 Allowed 'Trans proline' 0 N--CA 1.464 -0.224 0 C-N-CA 122.769 2.313 . . . . 0.0 112.251 179.997 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -120.61 163.71 17.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.756 179.868 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.51 ' O ' ' N ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -127.39 70.13 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.224 -179.845 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' A' ' 5' ' ' GLN . 12.9 pt20 -64.01 64.0 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.713 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.528 ' OD1' ' N ' ' A' ' 6' ' ' ASP . 4.9 p-10 -177.55 101.93 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.839 -179.81 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.451 ' N ' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER 34.28 60.31 2.08 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.114 179.968 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.605 ' O ' ' CA ' ' A' ' 30' ' ' GLY . 52.3 Cg_exo -54.06 107.17 0.2 Allowed 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 122.345 2.03 . . . . 0.0 111.612 179.53 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.484 ' C ' ' O ' ' A' ' 8' ' ' PRO . 7.6 tt0 -28.33 116.25 0.09 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.407 -179.631 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.537 ' HA ' ' HA2' ' A' ' 30' ' ' GLY . 1.8 t -48.12 118.96 2.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.575 179.965 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.43 ' OG1' ' O ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER 176.06 162.14 0.34 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.218 -179.538 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.749 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 6.0 mp -54.66 130.86 41.92 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.977 178.912 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.671 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.8 mm-40 -127.57 62.31 1.38 Allowed 'General case' 0 CA--C 1.506 -0.727 0 CA-C-O 122.357 1.075 . . . . 0.0 111.734 -179.853 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.678 ' O ' ' HD3' ' A' ' 16' ' ' PRO . 0.9 OUTLIER 6.46 125.87 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 112.241 -2.254 . . . . 0.0 112.295 179.538 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.69 ' HB2' HG23 ' A' ' 25' ' ' ILE . 0.5 OUTLIER -56.15 100.2 0.21 Allowed Pre-proline 0 C--N 1.314 -0.944 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.889 179.782 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.678 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 66.0 Cg_endo -72.86 4.81 3.35 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 121.738 1.625 . . . . 0.0 109.315 177.342 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.542 ' CD2' ' CE1' ' A' ' 18' ' ' PHE . 1.1 t80 -106.02 -57.87 1.99 Allowed 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 113.724 -1.58 . . . . 0.0 110.364 -179.839 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.72 ' CE2' HG22 ' A' ' 70' ' ' VAL . 3.6 m-30 -81.58 0.67 37.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.622 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.49 102.95 0.6 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.012 179.899 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.601 ' HB3' ' HD2' ' A' ' 21' ' ' PRO . 12.9 mt-30 -111.54 162.21 22.02 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.286 179.607 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.601 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 24.9 Cg_endo -60.47 66.37 0.08 OUTLIER 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.647 2.232 . . . . 0.0 111.812 179.773 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.537 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 147.14 -10.96 1.37 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.345 -179.623 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.558 ' CB ' ' H82' ' A' ' 178' ' ' NAG . . . -146.89 106.38 3.95 Favored Pre-proline 0 CA--C 1.514 -0.441 0 CA-C-O 121.858 0.837 . . . . 0.0 111.349 -179.662 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.546 ' HB2' ' CD ' ' A' ' 14' ' ' GLU . 97.3 Cg_endo -104.03 75.44 0.03 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.573 0 C-N-CA 124.752 3.634 . . . . 0.0 113.083 -178.48 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.878 HG22 HG22 ' A' ' 76' ' ' VAL . 15.5 mm -44.47 -175.35 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.911 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.838 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -146.04 -166.36 2.44 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 -176.026 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.534 ' O ' ' C ' ' A' ' 28' ' ' CYS . 0.0 OUTLIER 164.32 75.17 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 112.501 -2.136 . . . . 0.0 111.993 178.735 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.597 ' SG ' ' CD1' ' A' ' 12' ' ' LEU . 14.1 m -23.53 101.0 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.709 179.211 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.3 ttt -119.22 146.85 44.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.894 -179.388 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.605 ' CA ' ' O ' ' A' ' 8' ' ' PRO . . . 144.3 -163.06 27.87 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.929 179.846 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.416 ' O ' ' SG ' ' A' ' 31' ' ' CYS . 6.9 p -128.03 124.77 37.96 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.811 0.338 . . . . 0.0 110.786 -179.812 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.6 t -79.19 123.65 27.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.768 179.985 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -157.97 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.748 179.868 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.529 ' O ' ' C ' ' A' ' 35' ' ' ARG . 26.0 p -104.12 59.72 0.72 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.575 179.656 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.529 ' C ' ' O ' ' A' ' 34' ' ' SER . 2.8 tmm_? -24.5 133.72 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.228 -179.712 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -116.71 115.81 26.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.861 179.813 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER 60.44 85.86 0.17 Allowed Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.838 -179.972 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.464 ' HA ' ' HD3' ' A' ' 35' ' ' ARG . 94.2 Cg_exo -43.05 137.78 4.45 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.694 2.263 . . . . 0.0 112.324 179.952 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 62.3 p -52.52 152.02 6.98 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.139 -179.742 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.8 164.21 32.26 Favored 'Trans proline' 0 N--CA 1.465 -0.155 0 C-N-CA 122.925 2.417 . . . . 0.0 112.408 -179.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.493 ' O ' ' O ' ' A' ' 42' ' ' ARG . 1.3 pp -162.83 -26.42 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.171 179.803 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.493 ' O ' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -45.32 178.88 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.764 0.316 . . . . 0.0 110.851 -179.97 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.463 ' OG ' ' N ' ' A' ' 44' ' ' LYS . 87.0 p -118.32 -99.31 0.44 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.338 -179.809 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.463 ' N ' ' OG ' ' A' ' 43' ' ' SER . 3.5 ttmt -132.02 41.14 3.28 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.761 0.315 . . . . 0.0 111.174 -179.696 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 9.1 ttmt 66.06 174.67 0.23 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.931 179.753 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.64 ' OG1' ' N ' ' A' ' 47' ' ' MET . 0.1 OUTLIER 178.2 -169.34 0.09 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.842 -179.994 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.64 ' N ' ' OG1' ' A' ' 46' ' ' THR . 0.0 OUTLIER -34.91 160.33 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.12 179.914 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.448 ' C ' ' O ' ' A' ' 47' ' ' MET . 1.2 tt -30.88 129.93 0.12 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.406 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.9 m -97.61 144.57 10.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.056 179.733 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.31 -172.23 2.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.868 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.9 tttt -97.89 141.1 31.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.927 -179.827 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.543 ' N ' ' ND2' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -163.95 94.55 0.75 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.723 179.907 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 5.6 p -160.24 139.45 3.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.284 -179.852 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.423 ' O ' ' CB ' ' A' ' 55' ' ' SER . 73.3 p -65.98 -82.94 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.963 179.86 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.423 ' CB ' ' O ' ' A' ' 54' ' ' THR . 6.2 p 166.03 -166.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.424 -179.862 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -72.37 55.75 0.34 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.792 0.33 . . . . 0.0 110.916 179.869 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.1 p -147.74 122.8 10.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.724 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.431 ' C ' ' SG ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER -130.71 156.95 44.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.119 -179.732 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.431 ' SG ' ' C ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -172.11 139.98 1.14 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.752 179.69 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.443 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 96.6 m -70.91 126.21 28.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.324 -179.604 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.583 ' O ' ' C ' ' A' ' 62' ' ' ALA . 2.2 p -143.72 65.52 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.214 179.331 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.606 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 10.64 104.29 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.073 -179.224 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 1.046 ' N ' ' O ' ' A' ' 81' ' ' ALA . 70.4 tttt -53.35 -36.29 61.18 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 178.148 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.474 ' N ' ' HB2' ' A' ' 81' ' ' ALA . 8.0 m -139.08 163.01 33.54 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.326 -1.306 . . . . 0.0 108.558 178.867 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.72 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.7 OUTLIER -144.57 159.29 43.04 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.616 -179.236 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.858 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 0.9 OUTLIER -124.28 24.83 7.94 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 122.677 1.227 . . . . 0.0 107.817 176.88 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.558 ' HA ' ' HA ' ' A' ' 77' ' ' GLU . 3.9 ttt180 1.0 121.53 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 111.997 -2.365 . . . . 0.0 112.04 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.746 HG23 ' CD1' ' A' ' 25' ' ' ILE . 1.5 m -128.27 39.81 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.893 179.668 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.652 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 47.8 m -21.45 118.61 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.062 -179.454 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.72 HG22 ' CE2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -121.29 -168.87 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.775 0.797 . . . . 0.0 112.636 -178.767 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.476 ' HB2' ' CD2' ' A' ' 74' ' ' PHE . 61.0 mmm 30.17 -131.45 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.127 -1.397 . . . . 0.0 111.571 -179.918 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -63.04 -0.39 3.03 Favored Glycine 0 N--CA 1.442 -0.923 0 CA-C-N 115.342 -0.845 . . . . 0.0 113.271 -179.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.532 ' N ' ' O ' ' A' ' 70' ' ' VAL . . . 119.62 37.11 0.8 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.156 -179.782 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.652 ' O ' ' HA ' ' A' ' 69' ' ' THR . 32.2 m-85 -64.08 -178.67 0.36 Allowed 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.498 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.624 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -153.87 95.13 1.84 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -179.576 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.878 HG22 HG22 ' A' ' 25' ' ' ILE . 14.1 m -92.15 16.89 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.494 -1.201 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.323 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.72 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 22.38 45.12 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 -177.934 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.858 ' HB3' ' CA ' ' A' ' 66' ' ' ASN . 9.0 t-20 3.16 71.13 0.0 OUTLIER 'General case' 0 CA--C 1.498 -1.041 0 CA-C-N 114.407 -1.269 . . . . 0.0 107.601 -175.226 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.749 ' O ' ' CD2' ' A' ' 12' ' ' LEU . 33.2 m170 -41.99 115.06 0.61 Allowed 'General case' 0 C--N 1.304 -1.383 0 CA-C-O 122.372 1.082 . . . . 0.0 111.475 -176.277 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.657 ' CG2' ' HB2' ' A' ' 66' ' ' ASN . 11.0 p -114.02 -2.83 13.42 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 113.779 -1.555 . . . . 0.0 110.761 -178.578 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 1.046 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -168.35 112.48 0.61 Allowed 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.79 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.5 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.5 OUTLIER -99.87 153.96 18.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.692 0.282 . . . . 0.0 110.838 -179.284 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.4 ' O ' ' CG ' ' A' ' 83' ' ' HIS . 1.6 p80 -161.69 113.59 1.75 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.942 0.401 . . . . 0.0 111.092 -179.975 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.684 ' O ' ' CB ' ' A' ' 85' ' ' SER . 0.1 OUTLIER -72.41 111.12 7.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.701 179.946 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.684 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 13.5 t 136.9 164.75 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.095 179.942 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.407 ' CB ' ' O ' ' A' ' 85' ' ' SER . 3.2 m 77.78 69.16 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.118 179.875 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 1.6 m -117.04 135.78 53.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.273 -179.923 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 5.0 m-30 -89.91 49.76 1.77 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.405 179.477 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -169.29 -177.3 2.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.3 -179.724 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.511 ' CD2' ' HD2' ' A' ' 91' ' ' LYS . 0.0 OUTLIER -147.63 119.86 8.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.92 0.39 . . . . 0.0 111.113 -179.878 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.511 ' HD2' ' CD2' ' A' ' 90' ' ' HIS . 0.0 OUTLIER 64.59 79.06 0.27 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.086 179.881 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 71.1 m . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.715 179.828 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.673 ' C6 ' ' H1 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.673 ' H1 ' ' C6 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . 0.949 ' H62' ' H5 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . 0.575 ' O2 ' ' O7 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . 0.949 ' H5 ' ' H62' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.874 ' H4 ' ' O2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.58 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . 0.58 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . 0.874 ' O2 ' ' H4 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.429 ' HB2' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.867 0.365 . . . . 0.0 110.921 . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.597 ' O ' ' C ' ' A' ' 3' ' ' ASP . 20.7 Cg_exo -65.53 -156.48 0.03 OUTLIER 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.87 2.38 . . . . 0.0 111.98 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.597 ' C ' ' O ' ' A' ' 2' ' ' PRO . 0.4 OUTLIER 4.82 110.09 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.684 179.854 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 89.7 t -100.14 144.44 12.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.108 0.48 . . . . 0.0 111.805 -179.544 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.464 ' O ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -136.31 36.6 2.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.142 179.473 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.484 ' O ' ' C ' ' A' ' 7' ' ' CYS . 0.2 OUTLIER -53.35 -158.38 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.493 -179.401 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.484 ' C ' ' O ' ' A' ' 6' ' ' ASP . 1.2 p -25.25 144.82 0.03 OUTLIER Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.87 -179.567 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -57.81 -157.73 0.01 OUTLIER 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 123.154 2.569 . . . . 0.0 112.515 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.438 ' O ' ' CG2' ' A' ' 11' ' ' THR . 2.3 tt0 -89.81 130.48 36.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.32 -179.737 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.414 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -32.49 130.45 0.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.547 179.987 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.831 ' O ' ' N ' ' A' ' 29' ' ' MET . 0.1 OUTLIER -170.34 -160.42 0.22 Allowed 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.157 179.201 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.843 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 0.8 OUTLIER -74.98 135.77 41.33 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.462 -179.224 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.635 ' O ' ' O ' ' A' ' 14' ' ' GLU . 6.8 mt-30 -122.18 54.15 1.19 Allowed 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 121.715 0.769 . . . . 0.0 109.707 177.808 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.635 ' O ' ' O ' ' A' ' 13' ' ' GLN . 5.0 tt0 -2.93 125.66 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 113.495 -1.684 . . . . 0.0 111.445 -178.546 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.766 ' HB2' HG23 ' A' ' 25' ' ' ILE . 0.5 OUTLIER -62.16 106.0 0.74 Allowed Pre-proline 0 C--N 1.309 -1.173 0 CA-C-N 114.335 -1.302 . . . . 0.0 112.274 -179.176 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.429 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 4.3 Cg_exo -77.19 10.88 2.25 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 122.531 2.154 . . . . 0.0 109.415 177.453 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.564 ' CE1' ' SD ' ' A' ' 71' ' ' MET . 0.9 OUTLIER -106.48 -61.15 1.56 Allowed 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.138 -1.392 . . . . 0.0 111.296 -179.196 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.697 ' CG ' HG23 ' A' ' 70' ' ' VAL . 5.2 m-85 -81.72 -3.22 53.14 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.714 -178.718 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.664 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 58.4 p -58.75 89.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.974 0.416 . . . . 0.0 110.723 -179.886 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.589 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -88.57 165.99 25.18 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.933 179.731 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.473 ' HD2' ' HG3' ' A' ' 20' ' ' GLN . 22.6 Cg_endo -61.43 59.02 0.11 Allowed 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 122.348 2.032 . . . . 0.0 111.452 179.638 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.589 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 157.39 -16.53 0.34 Allowed Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 115.773 -0.648 . . . . 0.0 112.622 -179.534 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.634 ' HB1' ' C8 ' ' A' ' 178' ' ' NAG . . . -145.22 109.25 4.6 Favored Pre-proline 0 CA--C 1.517 -0.324 0 CA-C-O 121.966 0.889 . . . . 0.0 112.168 -179.316 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.904 ' HD2' ' H3 ' ' A' ' 178' ' ' NAG . 69.0 Cg_endo -101.81 78.81 0.04 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.284 0 C-N-CA 124.912 3.741 . . . . 0.0 113.401 -179.086 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.856 HG21 ' H ' ' A' ' 26' ' ' LEU . 5.6 mm -39.18 -176.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.856 ' H ' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.98 -160.12 1.09 Allowed 'General case' 0 CA--C 1.503 -0.856 0 CA-C-O 122.509 1.147 . . . . 0.0 113.955 -175.974 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 14.2 tt0 162.75 78.24 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 112.853 -1.976 . . . . 0.0 111.339 179.392 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.791 ' HA ' ' O ' ' A' ' 11' ' ' THR . 77.1 m -25.52 100.24 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.174 179.885 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.831 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.0 OUTLIER -136.07 146.08 46.67 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.942 179.8 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.76 -151.23 20.95 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.591 -179.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.438 ' SG ' ' O ' ' A' ' 31' ' ' CYS . 31.4 p -147.73 80.5 1.49 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.726 0.298 . . . . 0.0 110.936 179.99 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.574 ' O ' ' CD1' ' A' ' 33' ' ' PHE . 0.3 OUTLIER -37.78 -83.59 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.869 179.815 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 32' ' ' CYS . 35.7 m-85 -162.23 -38.51 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.961 -179.847 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.47 ' O ' ' HB3' ' A' ' 57' ' ' SER . 0.0 OUTLIER -111.54 116.97 31.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.941 179.883 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.436 ' O ' ' O ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -118.89 -162.21 0.89 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.997 179.836 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.436 ' O ' ' O ' ' A' ' 35' ' ' ARG . . . 45.35 -174.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.115 -179.808 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.582 ' O ' ' CD1' ' A' ' 37' ' ' TYR . 0.4 OUTLIER -102.78 124.42 38.95 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.847 179.937 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.93 179.67 0.71 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.781 2.32 . . . . 0.0 112.391 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.459 ' OG1' ' O ' ' A' ' 39' ' ' THR . 0.1 OUTLIER -114.97 101.13 54.44 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.875 179.965 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -87.5 -161.29 0.12 Allowed 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.082 2.521 . . . . 0.0 112.06 179.819 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.517 ' O ' ' N ' ' A' ' 43' ' ' SER . 4.8 mt -107.44 27.5 9.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.912 179.95 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.429 ' HD2' ' C ' ' A' ' 41' ' ' LEU . 0.8 OUTLIER 61.48 -73.71 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.993 0.425 . . . . 0.0 110.592 -179.899 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.523 ' O ' ' CB ' ' A' ' 44' ' ' LYS . 0.1 OUTLIER 51.14 -157.43 0.11 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.281 179.642 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' A' ' 43' ' ' SER . 0.1 OUTLIER 86.65 57.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.566 -179.634 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -157.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.876 -179.876 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.4 78.9 1.65 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.832 179.826 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -170.13 130.11 0.94 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.001 -179.861 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.69 74.82 2.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.212 -179.8 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.426 ' C ' ' HG2' ' A' ' 50' ' ' GLN . 0.7 OUTLIER -116.18 120.11 63.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.659 179.691 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.426 ' HG2' ' C ' ' A' ' 49' ' ' VAL . 0.1 OUTLIER -148.27 145.43 28.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.941 0.4 . . . . 0.0 111.194 -179.885 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.43 ' HB2' ' CG2' ' A' ' 53' ' ' VAL . 7.2 mmtp -137.81 23.53 2.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.78 179.9 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 54.7 36.44 26.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.735 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.43 ' CG2' ' HB2' ' A' ' 51' ' ' LYS . 1.5 t -96.82 162.51 2.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.95 179.92 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.422 HG21 ' O ' ' A' ' 53' ' ' VAL . 0.0 OUTLIER 176.36 -169.43 0.06 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.869 179.969 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.506 ' O ' ' O ' ' A' ' 56' ' ' GLU . 8.6 m -144.6 -57.4 0.36 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.984 -179.911 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.506 ' O ' ' O ' ' A' ' 55' ' ' SER . 1.0 OUTLIER 49.58 109.46 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.506 -179.709 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.486 ' C ' ' O ' ' A' ' 56' ' ' GLU . 0.3 OUTLIER -31.05 -82.83 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.837 -179.836 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.45 HG22 ' O ' ' A' ' 34' ' ' SER . 4.7 p -76.53 -177.28 4.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.538 179.597 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.645 ' O ' ' O ' ' A' ' 83' ' ' HIS . 1.8 t -152.62 28.28 0.55 Allowed 'General case' 0 CA--C 1.508 -0.642 0 CA-C-O 121.572 0.701 . . . . 0.0 111.356 -179.927 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.632 ' O ' ' CB ' ' A' ' 61' ' ' VAL . 33.5 m -62.5 -167.33 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.371 -1.286 . . . . 0.0 110.617 179.488 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.632 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 56.7 t 116.45 62.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.041 -179.535 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.57 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 10.23 108.36 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.514 -0.766 . . . . 0.0 112.196 -179.621 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.821 ' N ' ' O ' ' A' ' 81' ' ' ALA . 36.5 tttt -51.81 -33.36 35.41 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.582 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.54 ' CB ' ' OG1' ' A' ' 80' ' ' THR . 13.8 m -141.3 165.3 27.89 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.943 179.075 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.656 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 0.3 OUTLIER -147.22 161.83 40.14 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.239 0.542 . . . . 0.0 111.936 -179.356 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.795 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.1 OUTLIER -134.5 29.59 3.57 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-O 122.74 1.257 . . . . 0.0 107.698 176.787 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.616 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -9.76 128.73 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 112.029 -2.35 . . . . 0.0 112.163 -179.458 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.739 HG12 HD13 ' A' ' 25' ' ' ILE . 4.3 m -136.06 48.35 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 114.812 -1.086 . . . . 0.0 110.282 179.883 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.605 ' C ' ' O ' ' A' ' 68' ' ' VAL . 89.1 m -20.08 118.27 0.03 OUTLIER 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.048 -179.304 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.697 HG23 ' CG ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -120.48 -172.05 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-O 121.428 0.632 . . . . 0.0 112.525 -178.039 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.564 ' SD ' ' CE1' ' A' ' 17' ' ' PHE . 29.0 mmm 33.2 -127.64 0.06 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.791 -1.095 . . . . 0.0 111.147 -179.275 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -78.71 9.88 34.38 Favored Glycine 0 N--CA 1.438 -1.218 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.651 -179.817 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.551 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 128.68 24.76 1.08 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.763 179.969 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.578 ' O ' ' HA ' ' A' ' 69' ' ' THR . 5.7 m-30 -69.7 118.49 12.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.796 0.331 . . . . 0.0 110.999 -179.791 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.446 ' HB3' ' CD ' ' A' ' 67' ' ' ARG . 0.4 OUTLIER -105.87 110.64 23.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.071 0.462 . . . . 0.0 111.892 -179.668 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.843 HG22 HG21 ' A' ' 25' ' ' ILE . 17.7 m -95.21 12.05 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.439 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.44 178.958 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.72 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER 29.69 39.34 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 105.47 -2.048 . . . . 0.0 105.47 -176.636 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.795 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 55.3 t30 3.11 64.11 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.682 0 CA-C-N 113.341 -1.754 . . . . 0.0 108.405 -174.562 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.843 ' O ' ' CD2' ' A' ' 12' ' ' LEU . 35.8 m170 -38.0 114.05 0.32 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 113.399 -1.728 . . . . 0.0 112.818 -176.689 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.54 ' OG1' ' CB ' ' A' ' 64' ' ' SER . 3.0 p -98.54 -7.3 28.53 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 114.388 -1.278 . . . . 0.0 110.339 -179.734 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.821 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -169.32 136.8 1.8 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.89 178.741 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.65 ' SG ' ' CD1' ' A' ' 12' ' ' LEU . 6.9 m -119.67 119.37 33.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.653 0.263 . . . . 0.0 110.636 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.645 ' O ' ' O ' ' A' ' 59' ' ' CYS . 0.5 OUTLIER -109.2 106.7 16.67 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.917 0.389 . . . . 0.0 110.156 178.996 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.504 ' HB2' ' SG ' ' A' ' 60' ' ' CYS . 15.5 t -123.99 163.43 21.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.007 -179.387 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.633 ' O ' ' C ' ' A' ' 86' ' ' THR . 0.0 OUTLIER 66.47 -175.91 0.19 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.305 -179.759 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.633 ' C ' ' O ' ' A' ' 85' ' ' SER . 11.9 m 7.67 85.64 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.299 179.841 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.644 ' O ' ' HB2' ' A' ' 88' ' ' TYR . 59.9 m -65.38 59.53 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.961 0.41 . . . . 0.0 110.823 -179.725 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.644 ' HB2' ' O ' ' A' ' 87' ' ' CYS . 17.9 t80 156.21 21.96 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.4 179.889 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.611 ' CG ' ' O ' ' A' ' 89' ' ' TYR . 1.2 p90 -48.14 111.31 0.43 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.982 -179.703 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.479 ' O ' ' HB3' ' A' ' 91' ' ' LYS . 7.2 t-160 -64.06 -74.94 0.09 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.695 179.91 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 90' ' ' HIS . 0.0 OUTLIER 166.63 -37.58 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.113 -179.998 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.759 179.879 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.904 ' H3 ' ' HD2' ' A' ' 24' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.676 ' H1 ' ' C6 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.46 ' H3 ' ' O7 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.684 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . 0.684 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.626 ' CB ' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.487 1.407 0 CA-C-O 120.705 0.288 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.626 ' CD ' ' CB ' ' A' ' 1' ' ' ALA . 1.4 Cg_endo -43.4 -54.06 3.83 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.864 2.376 . . . . 0.0 111.999 179.751 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.587 ' CB ' ' O ' ' A' ' 2' ' ' PRO . 16.1 t0 94.9 90.55 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.41 179.581 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.495 ' C ' ' O ' ' A' ' 3' ' ' ASP . 13.2 m 24.42 -142.43 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.866 179.528 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.512 ' O ' ' CG ' ' A' ' 5' ' ' GLN . 20.2 tt0 -124.04 62.59 1.08 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.909 -179.78 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.475 ' OD1' ' O ' ' A' ' 6' ' ' ASP . 38.8 p30 -132.41 149.66 52.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.039 179.914 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.428 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 11.2 t -35.75 123.41 0.67 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.874 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.545 ' O ' ' O ' ' A' ' 9' ' ' GLU . 32.0 Cg_exo -58.97 78.55 0.05 OUTLIER 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 123.123 2.549 . . . . 0.0 113.563 -179.121 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.545 ' O ' ' O ' ' A' ' 8' ' ' PRO . 6.9 tt0 48.59 162.75 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.155 0.502 . . . . 0.0 112.013 178.65 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.418 ' SG ' ' HA3' ' A' ' 30' ' ' GLY . 11.3 t -56.71 132.29 51.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.171 179.943 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.665 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -149.16 -148.18 0.25 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.624 179.673 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.665 ' N ' ' OG1' ' A' ' 11' ' ' THR . 3.3 mp -116.21 141.23 48.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.002 0.43 . . . . 0.0 111.034 179.825 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.722 ' CG ' ' HA ' ' A' ' 29' ' ' MET . 1.3 mt-30 -98.93 45.75 1.0 Allowed 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 121.292 0.568 . . . . 0.0 110.896 179.778 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.662 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 0.9 OUTLIER -5.92 117.92 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.835 -178.729 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.727 ' HB2' HG23 ' A' ' 25' ' ' ILE . 0.5 OUTLIER -58.26 103.53 0.37 Allowed Pre-proline 0 C--N 1.304 -1.378 0 CA-C-N 114.063 -1.426 . . . . 0.0 112.455 -178.659 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.554 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 86.2 Cg_endo -77.4 4.36 5.99 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 122.119 1.879 . . . . 0.0 109.289 177.4 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.607 ' CE2' ' SD ' ' A' ' 71' ' ' MET . 0.8 OUTLIER -95.08 -64.41 1.07 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 113.659 -1.61 . . . . 0.0 109.742 179.563 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.612 ' CD2' ' CG ' ' A' ' 15' ' ' ASN . 7.8 m-85 -74.82 -4.4 37.55 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.994 179.339 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.574 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -57.69 88.57 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.542 179.856 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.723 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.8 OUTLIER -95.3 155.9 38.3 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.057 179.715 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -48.98 69.04 0.02 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.726 2.284 . . . . 0.0 111.754 179.709 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.723 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 137.25 -0.45 2.87 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.77 -179.572 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.537 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -153.94 104.39 2.47 Favored Pre-proline 0 CA--C 1.517 -0.311 0 CA-C-O 121.806 0.812 . . . . 0.0 112.178 -179.551 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.628 ' HD2' ' H3 ' ' A' ' 178' ' ' NAG . 63.2 Cg_endo -104.64 76.64 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 125.133 3.889 . . . . 0.0 113.491 -178.725 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.861 ' CG2' ' H ' ' A' ' 26' ' ' LEU . 10.1 mm -40.64 -173.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 179.728 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.861 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -151.51 -162.73 1.59 Allowed 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -176.298 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.641 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 35.7 tp60 168.18 50.97 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 113.099 -1.864 . . . . 0.0 111.967 179.55 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.605 ' O ' ' O ' ' A' ' 27' ' ' GLN . 0.8 OUTLIER 26.55 119.14 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 178.705 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.722 ' HA ' ' CG ' ' A' ' 13' ' ' GLN . 1.9 ttp -68.0 -67.97 0.42 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.304 177.921 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.418 ' HA3' ' SG ' ' A' ' 10' ' ' CYS . . . 85.95 100.54 0.74 Allowed Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.931 -0.652 . . . . 0.0 113.205 179.425 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' A' ' 33' ' ' PHE . 11.2 p -162.3 54.44 0.22 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.956 0.408 . . . . 0.0 110.173 179.494 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.2 m -62.88 64.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.991 -179.661 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.535 ' N ' ' O ' ' A' ' 31' ' ' CYS . 15.2 m-30 49.34 -170.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.949 -179.993 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 33' ' ' PHE . 0.1 OUTLIER 81.85 -15.19 0.73 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.545 -179.533 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.46 114.51 24.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.605 179.839 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -134.12 25.63 3.89 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.922 0.391 . . . . 0.0 111.368 -179.8 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.552 ' CD1' ' N ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -93.73 124.85 55.59 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.817 179.849 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.483 ' HB2' ' HD2' ' A' ' 40' ' ' PRO . 71.6 Cg_endo -87.94 167.84 6.86 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 122.921 2.414 . . . . 0.0 112.355 179.982 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.57 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -55.66 -57.46 21.11 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-O 121.869 0.842 . . . . 0.0 110.569 179.713 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.57 ' HD3' ' CB ' ' A' ' 39' ' ' THR . 88.6 Cg_endo -80.56 141.34 13.86 Favored 'Trans proline' 0 C--N 1.325 -0.709 0 C-N-CA 124.182 3.255 . . . . 0.0 112.306 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.507 ' O ' ' C ' ' A' ' 42' ' ' ARG . 0.4 OUTLIER -110.09 169.34 8.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.756 179.996 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.515 ' O ' ' N ' ' A' ' 44' ' ' LYS . 4.6 ttp180 -27.59 103.78 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.987 -179.876 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.458 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 1.5 m -64.16 58.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.017 -179.941 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 42' ' ' ARG . 60.1 mttm -161.82 143.45 11.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.664 -179.839 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.74 -170.16 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.65 179.78 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 38.61 63.54 0.87 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.127 179.772 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.0 ptp -95.4 158.08 15.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.052 179.895 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.18 174.35 5.99 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.225 -179.694 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.495 ' CG1' ' N ' ' A' ' 50' ' ' GLN . 2.0 t -143.56 158.05 16.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.085 -179.919 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.503 ' O ' ' HB2' ' A' ' 51' ' ' LYS . 0.1 OUTLIER 71.16 125.4 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.935 179.828 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 0.9 OUTLIER 171.16 116.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.175 179.846 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -157.99 -164.97 1.62 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.879 179.646 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.469 ' O ' ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -148.26 103.38 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.537 -179.936 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.469 ' O ' ' O ' ' A' ' 53' ' ' VAL . 9.0 m 56.1 124.31 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.09 179.661 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.422 ' OG ' ' C ' ' A' ' 54' ' ' THR . 0.0 OUTLIER 176.14 165.58 0.41 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.868 179.91 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.555 ' O ' ' CB ' ' A' ' 57' ' ' SER . 0.2 OUTLIER -120.04 -58.3 1.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.801 179.976 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 56' ' ' GLU . 1.8 m 156.73 -22.09 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.079 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.48 ' O ' ' CB ' ' A' ' 59' ' ' CYS . 18.0 p 48.41 178.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.79 -179.793 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.51 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 2.2 p 162.26 141.92 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.176 179.823 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.58 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -124.42 89.93 3.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.257 -179.748 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.534 ' O ' ' O ' ' A' ' 62' ' ' ALA . 2.2 m -77.29 64.0 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.83 179.715 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.614 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 26.11 106.88 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.749 0 CA-C-O 121.993 0.902 . . . . 0.0 112.471 -179.969 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.881 ' HG3' ' CB ' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -49.46 -47.14 48.57 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 113.724 -1.58 . . . . 0.0 107.708 177.023 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.554 ' CB ' ' OG1' ' A' ' 80' ' ' THR . 2.1 p -128.52 156.19 43.67 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 113.193 -1.822 . . . . 0.0 109.243 179.304 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.657 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -141.31 160.81 39.34 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.59 0.709 . . . . 0.0 112.424 -178.308 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.772 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -127.87 28.32 5.6 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-O 122.703 1.239 . . . . 0.0 107.684 177.378 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.542 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.9 OUTLIER -9.23 126.27 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 112.115 -2.311 . . . . 0.0 112.033 -179.688 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.723 HG23 ' CD1' ' A' ' 25' ' ' ILE . 3.1 m -129.55 43.03 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.212 179.466 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.577 ' C ' ' O ' ' A' ' 68' ' ' VAL . 53.9 m -16.16 118.95 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.136 -179.303 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.596 HG13 ' CD1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -125.75 -169.23 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.856 -179.574 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.607 ' SD ' ' CE2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER 41.91 -135.57 0.3 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.977 -1.011 . . . . 0.0 110.862 -179.704 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -78.94 21.14 4.13 Favored Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.667 179.935 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 114.88 41.09 0.86 Allowed Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.296 -179.982 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.564 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 3.2 m-85 -70.21 -175.73 1.03 Allowed 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 179.894 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.585 ' N ' ' CD ' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -160.15 94.39 1.1 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -179.552 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.778 HG22 HG21 ' A' ' 25' ' ' ILE . 31.4 m -88.98 11.8 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.491 -1.309 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.014 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.758 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 27.14 42.35 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 105.336 -2.098 . . . . 0.0 105.336 -176.81 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.772 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 57.4 t30 -1.69 67.21 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.828 0 CA-C-N 113.302 -1.772 . . . . 0.0 108.597 -174.414 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.758 ' N ' ' O ' ' A' ' 77' ' ' GLU . 37.6 m170 -34.27 122.33 0.49 Allowed 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 112.747 -2.024 . . . . 0.0 114.094 -176.493 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.554 ' OG1' ' CB ' ' A' ' 64' ' ' SER . 6.5 p -107.68 -34.25 7.05 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 113.483 -1.69 . . . . 0.0 109.513 178.362 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.881 ' CB ' ' HG3' ' A' ' 63' ' ' LYS . . . -143.17 143.41 31.78 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.808 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.555 ' CA ' ' HG2' ' A' ' 63' ' ' LYS . 1.2 m -129.6 129.86 44.92 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.943 -179.318 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.778 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 0.3 OUTLIER -120.05 105.91 11.48 Favored 'General case' 0 CA--C 1.522 -0.108 0 CA-C-O 121.07 0.462 . . . . 0.0 111.08 179.278 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.51 ' HA ' ' O ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER -81.29 143.55 32.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.595 179.83 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.405 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 4.5 p 168.76 -174.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.019 0.438 . . . . 0.0 111.277 179.991 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 23.9 p -48.1 126.83 11.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.855 -179.886 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.412 ' O ' ' CD1' ' A' ' 88' ' ' TYR . 1.3 m -67.82 64.45 0.08 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.704 179.758 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.451 ' O ' ' HB2' ' A' ' 89' ' ' TYR . 2.7 m-85 -155.1 142.47 19.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.025 -179.876 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.451 ' HB2' ' O ' ' A' ' 88' ' ' TYR . 3.2 m-85 66.84 75.77 0.31 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.015 179.974 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.493 ' O ' ' C ' ' A' ' 91' ' ' LYS . 7.6 m80 -72.93 -40.29 65.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.591 179.869 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.493 ' C ' ' O ' ' A' ' 90' ' ' HIS . 4.0 mmtt 27.28 70.61 0.05 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.233 -179.993 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.0 p . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.253 -0.88 . . . . 0.0 111.01 -179.994 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.628 ' H3 ' ' HD2' ' A' ' 24' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.529 ' N2 ' ' H61' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.447 ' HO6' ' C1 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.469 ' H5 ' ' O5 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . 0.469 ' O5 ' ' H5 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . 0.447 ' C1 ' ' HO6' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.853 0.359 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -87.16 -42.63 0.05 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 123.111 2.541 . . . . 0.0 112.759 -179.738 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -119.97 42.39 2.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.194 -179.632 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.1 m -148.34 174.26 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.941 179.831 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.44 ' HA ' ' OE1' ' A' ' 5' ' ' GLN . 2.4 mm-40 -161.23 47.77 0.21 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.099 -179.943 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.595 ' O ' ' C ' ' A' ' 7' ' ' CYS . 1.9 t70 77.5 -170.05 0.06 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.047 179.859 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.595 ' C ' ' O ' ' A' ' 6' ' ' ASP . 8.8 p -2.65 113.8 0.01 OUTLIER Pre-proline 0 N--CA 1.464 0.234 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.813 -179.788 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.423 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 49.2 Cg_exo -56.11 80.11 0.03 OUTLIER 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.954 2.436 . . . . 0.0 112.365 179.958 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.541 ' HG3' ' CA ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER 167.72 -178.69 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.886 -179.896 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.531 ' HB2' ' O ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER 83.73 94.17 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.535 -179.71 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.683 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 1.2 t -158.53 -125.43 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.148 -179.837 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.766 ' CD2' ' O ' ' A' ' 79' ' ' HIS . 11.1 mp -133.55 129.95 37.77 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.001 0.429 . . . . 0.0 110.919 179.644 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.655 ' O ' ' O ' ' A' ' 14' ' ' GLU . 28.1 mt-30 -106.64 55.51 0.66 Allowed 'General case' 0 CA--C 1.504 -0.824 0 CA-C-O 121.444 0.64 . . . . 0.0 111.717 -179.083 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.655 ' O ' ' O ' ' A' ' 13' ' ' GLN . 26.1 tt0 0.03 122.66 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 113.872 -1.513 . . . . 0.0 111.279 -179.611 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.697 ' OD1' ' CZ ' ' A' ' 17' ' ' PHE . 1.0 OUTLIER -51.44 104.34 0.42 Allowed Pre-proline 0 C--N 1.303 -1.422 0 CA-C-N 113.916 -1.493 . . . . 0.0 112.826 -179.116 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.705 ' HD2' ' CE1' ' A' ' 17' ' ' PHE . 55.3 Cg_endo -69.27 7.7 0.81 Allowed 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.161 1.908 . . . . 0.0 112.121 178.943 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.705 ' CE1' ' HD2' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -112.42 -58.95 2.07 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.22 178.778 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.66 ' HB3' ' HB ' ' A' ' 25' ' ' ILE . 0.4 OUTLIER -71.34 -17.03 62.46 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.556 -178.929 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.562 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -51.13 84.07 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.965 -179.606 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.57 ' O ' ' N ' ' A' ' 22' ' ' GLY . 11.4 mm100 -118.51 159.93 41.91 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.06 -179.855 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.494 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 12.9 Cg_endo -55.3 72.84 0.03 OUTLIER 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.868 2.379 . . . . 0.0 111.515 179.298 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.57 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 142.92 -13.35 2.39 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.961 -0.637 . . . . 0.0 111.903 -179.344 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.486 ' HB1' ' H81' ' A' ' 178' ' ' NAG . . . -150.55 102.22 3.09 Favored Pre-proline 0 CA--C 1.511 -0.525 0 CA-C-O 122.023 0.916 . . . . 0.0 111.826 -179.79 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.665 ' O ' ' O ' ' A' ' 25' ' ' ILE . 87.3 Cg_endo -104.18 60.47 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.543 0 C-N-CA 124.873 3.715 . . . . 0.0 112.433 -179.112 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.839 HG13 HG22 ' A' ' 68' ' ' VAL . 19.9 mm -38.63 -175.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-N 114.916 -1.038 . . . . 0.0 113.544 -179.839 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.813 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.13 -160.85 1.2 Allowed 'General case' 0 CA--C 1.503 -0.862 0 CA-C-O 122.398 1.094 . . . . 0.0 113.699 -174.99 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.554 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 16.6 tt0 163.63 66.2 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 113.179 -1.828 . . . . 0.0 111.261 179.298 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.704 ' CB ' ' HD1' ' A' ' 79' ' ' HIS . 38.9 t -18.96 115.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.573 179.874 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.501 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 0.6 OUTLIER -140.36 92.35 2.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.354 179.629 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.622 ' HA3' ' CE2' ' A' ' 33' ' ' PHE . . . -156.7 -144.96 4.07 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.904 -179.384 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.565 ' O ' ' HB2' ' A' ' 32' ' ' CYS . 11.8 t -30.35 152.79 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.875 0.369 . . . . 0.0 111.178 -179.948 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.565 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 61.3 m 79.54 10.97 1.36 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.599 -179.766 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.622 ' CE2' ' HA3' ' A' ' 30' ' ' GLY . 0.0 OUTLIER -99.39 15.59 25.82 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.872 179.61 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.504 ' O ' ' N ' ' A' ' 36' ' ' ALA . 2.3 p -131.55 -35.08 1.32 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.855 179.813 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.468 ' C ' ' O ' ' A' ' 34' ' ' SER . 0.1 OUTLIER -30.08 91.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.267 -179.912 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.559 ' O ' ' C ' ' A' ' 37' ' ' TYR . . . 176.58 34.34 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.159 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.559 ' C ' ' O ' ' A' ' 36' ' ' ALA . 58.9 m-85 -17.65 133.17 0.03 OUTLIER Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.606 179.954 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.471 ' O ' ' O ' ' A' ' 37' ' ' TYR . 73.9 Cg_exo -51.09 -165.93 0.0 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.584 2.189 . . . . 0.0 111.636 179.44 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.525 ' OG1' ' CB ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER 175.19 176.51 0.22 Allowed Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 121.019 0.438 . . . . 0.0 111.24 179.811 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.47 ' HD2' HG23 ' A' ' 39' ' ' THR . 73.8 Cg_endo -84.91 -68.23 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.924 2.416 . . . . 0.0 112.928 -179.691 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.406 ' H ' ' HG2' ' A' ' 40' ' ' PRO . 3.9 mt -83.93 -7.19 59.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.351 -179.57 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.525 ' CB ' ' OG1' ' A' ' 39' ' ' THR . 0.0 OUTLIER -71.58 130.27 40.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.897 -179.992 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.444 ' HB2' ' OG1' ' A' ' 46' ' ' THR . 0.2 OUTLIER -127.6 -178.51 4.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.134 -179.963 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.5 mttt -60.57 -82.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.937 -179.92 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.29 -7.08 8.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.043 -179.894 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.444 ' OG1' ' HB2' ' A' ' 43' ' ' SER . 0.0 OUTLIER -57.68 134.58 56.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.826 -179.953 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.426 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER 68.0 9.12 6.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.601 -179.634 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.426 ' HG ' ' C ' ' A' ' 47' ' ' MET . 0.0 OUTLIER 45.49 -173.25 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.285 179.728 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.439 ' O ' ' O ' ' A' ' 50' ' ' GLN . 2.4 m -143.58 164.25 15.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.906 -179.942 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.439 ' O ' ' O ' ' A' ' 49' ' ' VAL . 1.9 mm-40 -36.57 157.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.785 179.868 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.35 164.93 12.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.917 179.918 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.505 ' O ' ' O ' ' A' ' 53' ' ' VAL . 10.5 t-20 61.67 81.93 0.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.102 -179.964 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.505 ' O ' ' O ' ' A' ' 52' ' ' ASN . 18.7 m 35.52 -162.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.429 179.856 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.51 ' O ' ' O ' ' A' ' 55' ' ' SER . 0.2 OUTLIER -176.3 87.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.999 -179.838 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.51 ' O ' ' O ' ' A' ' 54' ' ' THR . 0.1 OUTLIER 35.1 99.36 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.077 179.921 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -117.28 155.75 28.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.172 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.46 ' O ' ' HA ' ' A' ' 85' ' ' SER . 0.0 OUTLIER -134.12 -41.89 0.81 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.64 179.742 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' A' ' 85' ' ' SER . 0.6 OUTLIER -95.53 167.03 11.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.687 179.649 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.581 ' C ' ' HA ' ' A' ' 84' ' ' CYS . 1.8 p 168.65 103.5 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.089 0.471 . . . . 0.0 112.179 179.686 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.616 ' O ' ' SG ' ' A' ' 82' ' ' CYS . 0.8 OUTLIER -88.96 47.99 1.57 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.444 178.894 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.65 ' O ' ' O ' ' A' ' 62' ' ' ALA . 31.0 m -76.22 65.66 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.241 179.312 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.65 ' HB3' ' CG ' ' A' ' 79' ' ' HIS . . . 24.06 107.93 0.0 OUTLIER 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.976 -178.621 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.906 ' HB2' ' CD2' ' A' ' 83' ' ' HIS . 1.2 ttmt -51.38 -36.24 42.43 Favored 'General case' 0 CA--C 1.503 -0.855 0 CA-C-O 121.797 0.808 . . . . 0.0 109.452 179.614 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.592 ' HB2' ' OG1' ' A' ' 80' ' ' THR . 2.0 p -143.84 142.16 30.7 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.193 -1.367 . . . . 0.0 109.044 178.864 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.672 ' CG ' ' CG ' ' A' ' 77' ' ' GLU . 1.1 p90 -129.54 165.92 20.72 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.672 0.749 . . . . 0.0 112.601 -178.775 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.774 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -133.96 27.48 3.9 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 114.401 -1.272 . . . . 0.0 107.76 176.688 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.659 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -6.86 121.91 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 112.077 -2.329 . . . . 0.0 112.053 179.911 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.839 HG22 HG13 ' A' ' 25' ' ' ILE . 3.8 m -129.16 44.12 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.055 179.516 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.705 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 36.6 m -18.09 118.0 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.68 -178.799 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.634 ' CG1' ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -110.92 -163.42 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.772 0.796 . . . . 0.0 111.812 179.538 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.619 ' HG3' ' CD2' ' A' ' 74' ' ' PHE . 2.4 ptm -34.14 145.57 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.393 -1.276 . . . . 0.0 111.519 -179.555 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 54.3 10.56 2.01 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.659 -0.782 . . . . 0.0 111.977 -179.532 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.491 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 80.68 33.84 29.62 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.192 -179.854 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.705 ' O ' ' HA ' ' A' ' 69' ' ' THR . 9.6 m-85 -65.44 110.29 2.62 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.988 0.423 . . . . 0.0 111.016 -179.873 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.498 ' CD ' ' OG1' ' A' ' 69' ' ' THR . 9.6 mmmt -94.1 98.48 11.02 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.525 -179.837 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.761 HG22 HG21 ' A' ' 25' ' ' ILE . 30.1 m -87.53 10.98 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.489 -1.381 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.136 179.149 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.783 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER 27.45 41.43 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 -177.396 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.774 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 45.0 t30 -0.67 64.95 0.0 OUTLIER 'General case' 0 CA--C 1.501 -0.916 0 CA-C-N 113.371 -1.741 . . . . 0.0 108.542 -174.48 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.783 ' N ' ' O ' ' A' ' 77' ' ' GLU . 36.9 m170 -37.12 122.05 0.84 Allowed 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 112.75 -2.023 . . . . 0.0 113.746 -176.503 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.592 ' OG1' ' HB2' ' A' ' 64' ' ' SER . 2.6 p -108.29 -8.86 15.59 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 113.504 -1.68 . . . . 0.0 109.622 178.718 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.795 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -173.99 137.52 0.57 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.81 179.001 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.776 ' C ' ' CD2' ' A' ' 83' ' ' HIS . 1.8 t -127.7 131.26 49.79 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.7 0.286 . . . . 0.0 111.164 179.855 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.906 ' CD2' ' HB2' ' A' ' 63' ' ' LYS . 3.9 m-70 -142.91 116.95 9.43 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.642 -179.821 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.632 ' O ' ' CB ' ' A' ' 85' ' ' SER . 0.0 OUTLIER -91.95 117.81 30.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.49 179.627 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.632 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 6.9 t 98.04 54.74 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.617 -179.532 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.515 HG22 ' CB ' ' A' ' 83' ' ' HIS . 0.1 OUTLIER -156.97 35.73 0.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.362 -179.849 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 93.3 m -96.11 -168.8 1.81 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.27 -179.644 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.428 ' O ' ' HB3' ' A' ' 89' ' ' TYR . 1.2 t80 -91.05 -153.37 0.31 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.34 -179.645 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.525 ' O ' ' CB ' ' A' ' 90' ' ' HIS . 80.0 t80 67.06 132.21 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.224 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.525 ' CB ' ' O ' ' A' ' 89' ' ' TYR . 0.7 OUTLIER 85.19 116.83 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.051 179.664 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.461 ' O ' ' C ' ' A' ' 92' ' ' SER . 0.1 OUTLIER -173.81 141.02 0.79 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.042 179.865 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.461 ' C ' ' O ' ' A' ' 91' ' ' LYS . 15.1 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.986 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.513 ' H62' ' C7 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.651 ' H3 ' ' O7 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . 0.643 ' H4 ' ' H1 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . 0.643 ' H1 ' ' H4 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.59 ' H4 ' ' O2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.766 ' H3 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . 0.766 ' O2 ' ' H3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . 0.59 ' O2 ' ' H4 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.593 ' CB ' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.713 0.292 . . . . 0.0 111.301 . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.593 ' CD ' ' CB ' ' A' ' 1' ' ' ALA . 76.8 Cg_exo -38.75 -31.5 0.24 Allowed 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.939 2.426 . . . . 0.0 112.849 -179.768 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.43 ' OD2' ' HG3' ' A' ' 8' ' ' PRO . 0.3 OUTLIER -114.29 90.02 3.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.843 0.354 . . . . 0.0 111.249 -179.572 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.7 t -50.21 116.78 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.571 179.647 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 64.33 166.99 0.16 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.327 -179.681 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 73.17 135.22 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.334 -179.586 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.622 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 0.5 OUTLIER -107.22 103.97 50.39 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.242 0.544 . . . . 0.0 111.664 -179.479 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.512 ' HD2' ' HE1' ' A' ' 29' ' ' MET . 5.7 Cg_endo -86.06 161.62 10.17 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.349 2.7 . . . . 0.0 111.857 179.91 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.481 ' C ' ' O ' ' A' ' 8' ' ' PRO . 0.6 OUTLIER -28.06 140.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.96 0.409 . . . . 0.0 110.942 179.928 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.454 ' C ' ' O ' ' A' ' 9' ' ' GLU . 44.3 t -33.27 114.86 0.19 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.073 -179.815 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.505 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 0.8 OUTLIER -136.56 -142.04 0.17 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.667 179.844 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.691 ' HG ' ' HB2' ' A' ' 79' ' ' HIS . 1.5 mp -114.94 140.88 48.65 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.714 0.293 . . . . 0.0 110.368 179.633 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.729 ' HG3' ' HA ' ' A' ' 29' ' ' MET . 3.1 mm-40 -101.2 50.08 0.87 Allowed 'General case' 0 CA--C 1.499 -0.991 0 CA-C-O 121.936 0.874 . . . . 0.0 111.204 -179.41 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.653 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 2.2 tt0 -0.25 120.12 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 113.183 -1.826 . . . . 0.0 111.554 -179.4 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.697 ' HB2' HG23 ' A' ' 25' ' ' ILE . 1.1 t-20 -52.55 120.29 17.82 Favored Pre-proline 0 C--N 1.308 -1.204 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.56 -179.815 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -82.34 16.93 1.67 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.479 2.119 . . . . 0.0 112.094 179.592 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.609 ' CE2' ' HG3' ' A' ' 71' ' ' MET . 86.9 t80 -123.73 -54.69 1.74 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.874 -179.921 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.827 ' HB3' ' CG1' ' A' ' 25' ' ' ILE . 0.3 OUTLIER -75.09 -7.47 53.83 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.318 -179.353 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.602 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -60.0 101.58 0.13 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.651 -179.308 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.579 ' CB ' ' HD2' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -115.41 177.45 1.19 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.265 179.334 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.579 ' HD2' ' CB ' ' A' ' 20' ' ' GLN . 59.5 Cg_endo -71.44 60.38 2.64 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.484 2.122 . . . . 0.0 111.748 179.566 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 149.65 -10.06 0.92 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.499 -179.576 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.463 ' CB ' ' H81' ' A' ' 178' ' ' NAG . . . -146.95 99.4 4.0 Favored Pre-proline 0 CA--C 1.509 -0.625 0 CA-C-O 122.15 0.976 . . . . 0.0 112.021 -179.657 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.707 ' HD2' ' H3 ' ' A' ' 178' ' ' NAG . 98.0 Cg_endo -104.8 79.94 0.02 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.707 0 C-N-CA 125.094 3.863 . . . . 0.0 112.687 -179.054 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.86 ' CG2' ' H ' ' A' ' 26' ' ' LEU . 24.3 mm -42.56 -173.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-N 115.509 -0.769 . . . . 0.0 113.019 -179.939 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.86 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.97 -159.18 0.97 Allowed 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 -174.822 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.671 ' O ' ' O ' ' A' ' 28' ' ' CYS . 4.0 tm0? 166.04 56.96 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 112.603 -2.09 . . . . 0.0 111.143 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.671 ' O ' ' O ' ' A' ' 27' ' ' GLN . 0.8 OUTLIER 18.37 119.16 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.918 179.876 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.729 ' HA ' ' HG3' ' A' ' 13' ' ' GLN . 5.8 tmm? -73.39 -89.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.899 179.041 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.42 ' O ' ' SD ' ' A' ' 29' ' ' MET . . . 114.22 117.04 3.25 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.501 -179.961 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 178.42 58.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.841 0.353 . . . . 0.0 110.74 179.927 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.462 ' HB2' HG23 ' A' ' 58' ' ' THR . 0.0 OUTLIER -92.66 -171.67 2.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.461 179.829 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.441 ' O ' ' CB ' ' A' ' 34' ' ' SER . 0.1 OUTLIER -174.23 172.64 3.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.906 0.384 . . . . 0.0 111.019 179.996 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.441 ' CB ' ' O ' ' A' ' 33' ' ' PHE . 0.5 OUTLIER 165.07 38.75 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.869 -179.871 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.462 ' HD2' ' C ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER 40.34 96.74 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.005 -179.967 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.78 140.38 58.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.826 179.737 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.602 ' O ' ' CG ' ' A' ' 37' ' ' TYR . 14.7 t80 -142.62 43.02 0.45 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.914 179.952 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 37' ' ' TYR . 18.6 Cg_endo -59.49 -166.78 0.03 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.524 2.15 . . . . 0.0 112.046 179.759 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 40' ' ' PRO . 1.6 t -81.78 152.89 69.86 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.763 179.883 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.434 ' O ' ' C ' ' A' ' 41' ' ' LEU . 5.5 Cg_endo -85.91 52.28 2.98 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.253 2.635 . . . . 0.0 112.165 179.934 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.434 ' C ' ' O ' ' A' ' 40' ' ' PRO . 1.9 mp 35.19 -152.91 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.705 -179.786 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.52 -30.08 8.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.787 179.918 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.403 ' CB ' ' HE3' ' A' ' 45' ' ' LYS . 1.1 m 173.54 -35.11 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.861 179.931 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.2 tptm 66.76 14.5 9.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.63 -179.796 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.483 ' O ' ' HB ' ' A' ' 46' ' ' THR . 9.6 pttp -79.49 105.63 10.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.948 -179.969 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.483 ' HB ' ' O ' ' A' ' 45' ' ' LYS . 0.4 OUTLIER 167.7 169.93 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.59 -179.965 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.408 ' HG2' HG22 ' A' ' 46' ' ' THR . 0.0 OUTLIER -51.33 -177.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.726 179.866 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.489 ' C ' ' CD1' ' A' ' 48' ' ' LEU . 2.9 pp -139.63 165.71 26.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.922 179.972 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.496 ' O ' ' O ' ' A' ' 50' ' ' GLN . 1.2 p -165.82 127.24 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.024 179.699 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.496 ' O ' ' O ' ' A' ' 49' ' ' VAL . 0.3 OUTLIER 49.11 109.64 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.121 179.803 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.7 mttt -55.87 176.13 0.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.258 179.454 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -135.21 153.39 51.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.113 0.483 . . . . 0.0 111.258 -179.897 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -137.61 90.67 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.808 179.597 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -158.49 122.73 4.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.796 -179.986 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.569 ' O ' ' C ' ' A' ' 56' ' ' GLU . 4.6 m -129.3 90.57 3.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.176 -179.771 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.569 ' C ' ' O ' ' A' ' 55' ' ' SER . 0.0 OUTLIER 12.46 104.93 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.849 179.753 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.42 ' O ' ' C ' ' A' ' 58' ' ' THR . 3.2 m -116.66 49.55 1.15 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.003 179.899 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.462 HG23 ' HB2' ' A' ' 32' ' ' CYS . 40.6 p 37.12 -145.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.786 179.871 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.676 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 0.8 OUTLIER -151.36 97.8 2.45 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.057 0.456 . . . . 0.0 112.125 -179.83 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.488 ' SG ' ' HB2' ' A' ' 84' ' ' CYS . 59.2 m -89.36 165.57 14.29 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.39 179.13 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.593 ' O ' ' C ' ' A' ' 62' ' ' ALA . 1.3 p 162.68 66.18 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.298 -179.697 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.593 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 3.03 103.32 0.01 OUTLIER 'General case' 0 CA--C 1.504 -0.793 0 CA-C-O 121.913 0.863 . . . . 0.0 112.559 -179.294 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.8 ' HG3' ' CB ' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -48.36 -44.19 34.24 Favored 'General case' 0 CA--C 1.49 -1.327 0 CA-C-N 113.845 -1.525 . . . . 0.0 107.134 177.014 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.75 ' HB3' ' OG1' ' A' ' 80' ' ' THR . 14.2 t -125.54 -178.61 4.3 Favored 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 112.849 -1.978 . . . . 0.0 109.407 179.647 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.625 ' CB ' ' CG ' ' A' ' 77' ' ' GLU . 3.0 p90 -162.27 160.51 26.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.281 0.562 . . . . 0.0 111.703 -179.491 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.945 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 43.9 t-20 -133.92 28.93 3.82 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 122.851 1.31 . . . . 0.0 107.696 177.501 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.55 ' O ' ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -6.14 130.3 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 111.616 -2.538 . . . . 0.0 112.551 -179.856 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.81 HG22 HG13 ' A' ' 25' ' ' ILE . 3.5 m -139.78 47.8 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.311 179.696 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.618 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 90.1 m -15.89 118.13 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.285 -179.016 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.772 ' CG1' ' CD1' ' A' ' 18' ' ' PHE . 3.0 m -120.28 -160.46 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.8 0 CA-C-O 121.726 0.774 . . . . 0.0 111.913 -179.867 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.609 ' HG3' ' CE2' ' A' ' 17' ' ' PHE . 29.0 mtp -13.04 131.61 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 113.874 -1.512 . . . . 0.0 112.854 -178.955 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 40.03 24.78 0.06 OUTLIER Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 115.458 -0.792 . . . . 0.0 113.214 179.059 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.53 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 84.91 36.98 10.58 Favored Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.872 179.724 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.696 ' HB2' ' CG2' ' A' ' 70' ' ' VAL . 1.2 m-30 -74.59 122.14 22.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.931 0.395 . . . . 0.0 110.822 179.923 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.18 109.62 22.28 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.784 -179.483 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.793 HG22 HG21 ' A' ' 25' ' ' ILE . 34.8 m -98.87 11.76 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.229 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.53 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.705 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER 25.27 42.32 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 -176.968 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.945 ' HB3' ' HB3' ' A' ' 66' ' ' ASN . 51.6 t30 -1.3 67.75 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 113.185 -1.825 . . . . 0.0 109.083 -174.466 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.705 ' N ' ' O ' ' A' ' 77' ' ' GLU . 39.1 m170 -37.36 121.09 0.82 Allowed 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 112.928 -1.942 . . . . 0.0 113.781 -176.921 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.75 ' OG1' ' HB3' ' A' ' 64' ' ' SER . 2.2 p -104.47 -32.2 9.11 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 113.448 -1.706 . . . . 0.0 109.21 178.203 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.8 ' CB ' ' HG3' ' A' ' 63' ' ' LYS . . . -143.15 136.06 27.83 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 177.795 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 1.2 m -124.25 134.74 53.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.902 0.382 . . . . 0.0 110.852 179.973 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.561 ' HB3' ' HD2' ' A' ' 63' ' ' LYS . 2.0 p80 -119.62 107.39 13.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.384 -179.468 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.676 ' HA ' ' O ' ' A' ' 59' ' ' CYS . 0.5 OUTLIER -108.44 117.55 34.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.309 179.391 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 3.0 p 92.56 175.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.741 -179.638 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 46.73 23.97 0.29 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.929 179.971 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.508 ' O ' ' C ' ' A' ' 88' ' ' TYR . 2.3 p -72.04 105.32 3.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.718 179.95 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.508 ' C ' ' O ' ' A' ' 87' ' ' CYS . 5.1 m-30 -25.18 115.7 0.05 Allowed 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.221 -179.765 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.43 -175.23 4.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.833 -179.599 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.445 ' O ' ' C ' ' A' ' 91' ' ' LYS . 0.2 OUTLIER -163.54 25.52 0.08 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.696 179.797 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.445 ' C ' ' O ' ' A' ' 90' ' ' HIS . 8.0 mmtp 34.22 38.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.74 -179.857 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.189 -0.91 . . . . 0.0 110.923 -179.892 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.707 ' H3 ' ' HD2' ' A' ' 24' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.584 ' H3 ' ' O7 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . 0.524 ' H1 ' ' H62' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . 0.541 ' H1 ' ' O7 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . 0.479 ' H5 ' ' H5 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.776 ' H4 ' ' O2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.755 ' O7 ' ' C1 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . 0.439 ' C1 ' ' HO6' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . 0.776 ' O2 ' ' H4 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.403 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.715 0.293 . . . . 0.0 110.876 . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 1' ' ' ALA . 2.6 Cg_exo -75.28 108.55 2.73 Favored 'Trans proline' 0 N--CA 1.463 -0.277 0 C-N-CA 122.943 2.429 . . . . 0.0 112.417 -179.708 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.514 ' O ' HG21 ' A' ' 4' ' ' VAL . 0.2 OUTLIER -146.83 26.89 1.1 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.978 179.869 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.514 HG21 ' O ' ' A' ' 3' ' ' ASP . 7.6 m 33.45 33.5 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.083 179.927 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.507 ' N ' ' O ' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -94.2 -166.49 1.5 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.98 179.982 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.464 ' OD1' ' NE2' ' A' ' 5' ' ' GLN . 0.0 OUTLIER -58.81 109.92 0.91 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.925 -179.981 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.427 ' C ' ' O ' ' A' ' 6' ' ' ASP . 35.4 t -35.44 123.22 0.63 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.023 179.982 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.517 ' O ' ' CZ ' ' A' ' 33' ' ' PHE . 42.9 Cg_exo -57.13 -155.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 122.963 2.442 . . . . 0.0 112.494 -179.92 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.493 ' O ' ' C ' ' A' ' 10' ' ' CYS . 3.0 tt0 -124.1 139.61 53.77 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.144 -179.881 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.537 ' HA ' ' C ' ' A' ' 30' ' ' GLY . 49.0 t -27.32 120.41 0.1 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.389 179.818 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.698 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 9.2 t -170.14 -176.05 2.15 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-O 121.185 0.517 . . . . 0.0 110.821 179.582 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.697 ' CD2' ' HB2' ' A' ' 79' ' ' HIS . 2.4 mp -95.41 138.12 33.54 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.668 179.354 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.73 ' O ' ' O ' ' A' ' 14' ' ' GLU . 3.7 pt20 -123.0 69.23 0.99 Allowed 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 122.134 0.969 . . . . 0.0 111.749 178.831 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.73 ' O ' ' O ' ' A' ' 13' ' ' GLN . 28.0 tt0 14.78 123.57 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 112.704 -2.044 . . . . 0.0 112.255 179.998 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.874 ' HB2' HG23 ' A' ' 25' ' ' ILE . 33.2 t-20 -48.05 107.26 0.71 Allowed Pre-proline 0 C--N 1.306 -1.31 0 CA-C-N 113.527 -1.67 . . . . 0.0 112.072 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.744 ' HD2' ' CE1' ' A' ' 17' ' ' PHE . 72.8 Cg_endo -73.81 16.37 0.52 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.407 2.072 . . . . 0.0 112.958 179.7 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.744 ' CE1' ' HD2' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -126.24 -57.54 1.39 Allowed 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 121.787 0.804 . . . . 0.0 110.205 178.832 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.759 ' HB3' ' HB ' ' A' ' 25' ' ' ILE . 2.7 t80 -71.92 -19.19 61.96 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.219 -179.088 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.575 ' HB3' ' O ' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -48.76 87.61 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.546 -179.983 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.522 ' O ' ' N ' ' A' ' 22' ' ' GLY . 10.2 mm-40 -112.3 166.3 11.25 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.941 -179.65 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -61.85 60.83 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.752 2.301 . . . . 0.0 111.329 179.337 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.522 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 155.45 -14.24 0.45 Allowed Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.635 -179.611 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.419 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -142.97 108.87 5.44 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-O 121.784 0.802 . . . . 0.0 111.678 -179.492 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.634 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.8 Cg_endo -103.97 60.39 0.02 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.428 0 C-N-CA 124.613 3.542 . . . . 0.0 113.199 -178.556 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.9 HG13 HG22 ' A' ' 68' ' ' VAL . 31.6 mm -43.48 -174.07 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 CA-C-N 115.327 -0.852 . . . . 0.0 112.566 179.194 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.751 ' H ' ' CG2' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -145.23 -168.27 2.9 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -175.011 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 172.4 96.01 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 111.482 -2.599 . . . . 0.0 109.99 179.2 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.698 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -40.51 112.49 0.29 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.83 -178.924 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.541 ' O ' ' O ' ' A' ' 30' ' ' GLY . 0.0 OUTLIER -121.26 -19.01 7.21 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.463 -0.495 . . . . 0.0 111.946 -179.874 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.541 ' O ' ' O ' ' A' ' 29' ' ' MET . . . -44.59 179.99 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.342 -0.932 . . . . 0.0 112.377 179.978 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.502 ' SG ' ' O ' ' A' ' 31' ' ' CYS . 15.4 p -144.75 104.05 3.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.953 0.406 . . . . 0.0 110.756 179.619 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -79.84 135.27 36.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.135 -179.62 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.517 ' CZ ' ' O ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -135.04 130.33 35.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.729 179.886 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.0 p -42.89 153.05 0.09 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.132 -179.939 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.5 ' HB2' ' CZ ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -95.9 166.37 11.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.252 -179.84 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.437 ' HB2' ' O ' ' A' ' 35' ' ' ARG . . . 73.39 138.66 0.06 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.453 179.821 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -63.25 156.21 70.26 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.799 179.904 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.414 ' O ' HG22 ' A' ' 39' ' ' THR . 63.1 Cg_endo -73.96 114.29 4.0 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.608 2.205 . . . . 0.0 112.361 -179.964 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.414 HG22 ' O ' ' A' ' 38' ' ' PRO . 1.1 p -167.43 164.35 9.38 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.982 -179.941 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -80.29 -166.15 0.39 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.152 2.568 . . . . 0.0 112.091 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.489 ' HG ' ' N ' ' A' ' 42' ' ' ARG . 0.2 OUTLIER 177.72 -35.83 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.69 179.888 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.656 ' O ' ' CB ' ' A' ' 43' ' ' SER . 0.0 OUTLIER 82.01 79.31 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.062 179.795 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.656 ' CB ' ' O ' ' A' ' 42' ' ' ARG . 8.9 t 142.17 5.53 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.049 179.73 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.47 ' C ' ' O ' ' A' ' 43' ' ' SER . 2.1 tttp -31.1 130.69 0.11 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.821 0.343 . . . . 0.0 111.169 -179.998 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.521 ' O ' ' C ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -54.62 114.88 1.86 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.494 179.767 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.521 ' C ' ' O ' ' A' ' 45' ' ' LYS . 5.4 t -26.25 91.44 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.991 -179.804 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.51 ' N ' ' O ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -73.85 150.45 40.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.159 -179.58 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.611 ' N ' ' CD1' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -145.53 159.08 43.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.884 -179.918 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.479 HG22 ' OG ' ' A' ' 55' ' ' SER . 0.0 OUTLIER -127.58 172.27 14.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.062 -179.945 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -42.55 138.77 1.73 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.529 179.943 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.594 ' HE3' ' CD2' ' A' ' 88' ' ' TYR . 32.9 mttp 46.18 -139.64 0.49 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.27 -179.811 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -132.67 19.55 4.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.053 0.454 . . . . 0.0 110.416 179.359 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.408 ' O ' ' O ' ' A' ' 54' ' ' THR . 33.5 m -149.24 162.25 4.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.889 179.906 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.471 HG21 ' O ' ' A' ' 54' ' ' THR . 2.6 m 44.55 96.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.953 -179.851 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.479 ' OG ' HG22 ' A' ' 49' ' ' VAL . 1.7 m -93.32 152.8 18.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.977 -179.984 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.429 ' O ' ' CB ' ' A' ' 57' ' ' SER . 13.1 mt-10 -143.28 -79.34 0.21 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.876 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.429 ' CB ' ' O ' ' A' ' 56' ' ' GLU . 4.1 p 164.75 -178.65 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.613 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.3 p -42.47 155.47 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.774 -179.914 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.488 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 18.8 p -148.8 129.51 14.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.136 0.493 . . . . 0.0 111.539 -179.737 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.667 ' O ' ' CG2' ' A' ' 61' ' ' VAL . 71.0 m -85.86 -169.87 2.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.145 179.77 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.667 ' CG2' ' O ' ' A' ' 60' ' ' CYS . 2.6 t 142.59 79.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.377 179.822 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.587 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . -6.11 105.75 0.01 OUTLIER 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 122.065 0.936 . . . . 0.0 112.415 -179.916 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.791 ' HG3' ' CB ' ' A' ' 81' ' ' ALA . 0.1 OUTLIER -50.51 -43.53 55.77 Favored 'General case' 0 CA--C 1.495 -1.142 0 CA-C-N 113.733 -1.576 . . . . 0.0 108.397 177.802 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.607 ' CB ' ' OG1' ' A' ' 80' ' ' THR . 43.7 m -133.11 135.51 45.29 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 113.637 -1.619 . . . . 0.0 109.48 179.906 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.77 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -125.71 163.02 23.73 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.604 0.716 . . . . 0.0 112.436 -177.88 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.782 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -132.12 30.18 4.27 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 122.704 1.24 . . . . 0.0 107.9 177.388 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.595 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.2 OUTLIER -8.69 128.15 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 112.075 -2.329 . . . . 0.0 112.148 -179.786 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.9 HG22 HG13 ' A' ' 25' ' ' ILE . 4.6 m -134.84 49.52 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.454 179.915 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.658 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 55.2 m -23.2 118.62 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.196 -179.173 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.666 ' CG1' ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -111.65 -167.39 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.726 0.774 . . . . 0.0 112.366 -179.603 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.521 ' C ' ' O ' ' A' ' 70' ' ' VAL . 1.2 mmm 16.62 -131.7 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.14 -1.391 . . . . 0.0 112.191 -179.937 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.81 -4.06 1.97 Allowed Glycine 0 N--CA 1.445 -0.74 0 CA-C-N 115.447 -0.797 . . . . 0.0 113.287 -179.63 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.583 ' HA3' ' CG2' ' A' ' 69' ' ' THR . . . 130.22 28.68 0.7 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.137 -179.766 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.658 ' O ' ' HA ' ' A' ' 69' ' ' THR . 23.0 m-85 -66.13 120.42 13.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.831 0.348 . . . . 0.0 110.943 -179.644 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.505 ' HB3' ' HD3' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -99.79 115.56 29.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.804 -179.391 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.832 HG23 HG22 ' A' ' 25' ' ' ILE . 19.0 m -104.16 11.14 8.51 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.273 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.989 178.967 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.77 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 27.39 41.5 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 -177.172 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.782 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 50.3 t30 -1.23 68.09 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 113.729 -1.578 . . . . 0.0 109.149 -174.566 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.735 ' N ' ' O ' ' A' ' 77' ' ' GLU . 41.8 m170 -38.59 120.19 0.91 Allowed 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 112.57 -2.105 . . . . 0.0 113.905 -176.743 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.607 ' OG1' ' CB ' ' A' ' 64' ' ' SER . 2.2 p -105.14 -34.88 7.79 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 113.503 -1.681 . . . . 0.0 109.557 178.542 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.791 ' CB ' ' HG3' ' A' ' 63' ' ' LYS . . . -140.89 140.04 34.48 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 177.625 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.8 OUTLIER -128.09 133.71 49.06 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.59 -0.444 . . . . 0.0 111.818 -179.071 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.552 ' O ' ' HA ' ' A' ' 60' ' ' CYS . 8.0 p80 -114.95 -175.39 2.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.673 179.713 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 59' ' ' CYS . 7.8 t -172.35 104.39 0.17 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.446 179.869 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.562 ' O ' ' C ' ' A' ' 86' ' ' THR . 2.7 p 162.32 164.01 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.93 -179.757 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.562 ' C ' ' O ' ' A' ' 85' ' ' SER . 54.6 m -15.65 113.22 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.513 -179.861 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 36.3 m -80.84 -173.21 4.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.365 -179.706 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.594 ' CD2' ' HE3' ' A' ' 51' ' ' LYS . 0.0 OUTLIER 62.96 175.64 0.15 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.009 179.876 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.47 ' O ' ' HB3' ' A' ' 90' ' ' HIS . 11.4 t80 58.69 126.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.862 179.916 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.576 ' CG ' ' O ' ' A' ' 90' ' ' HIS . 28.7 t60 66.5 59.69 0.62 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.011 0.434 . . . . 0.0 110.402 -179.673 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.9 -63.54 1.15 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.106 -179.717 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.913 -179.879 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 178' ' ' NAG . . . . . 0.511 ' H82' ' CD1' ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 179' ' ' NAG . . . . . 0.551 ' H62' ' H1 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 180' ' ' BMA . . . . . 0.551 ' H1 ' ' H62' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 181' ' ' MAN . . . . . 0.538 ' O3 ' ' H5 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 182' ' ' MAN . . . . . 0.505 ' C1 ' ' HO4' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 183' ' ' NAG . . . . . 0.538 ' H5 ' ' O3 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 184' ' ' NAG . . . . . 0.588 ' H61' ' H1 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 185' ' ' GAL . . . . . 0.588 ' H1 ' ' H61' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 186' ' ' GAL . . . . . 0.453 ' H1 ' ' O6 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.754 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 7.1 t . . . . . 0 CA--C 1.518 -0.252 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.054 HD23 HD13 ' A' ' 26' ' ' LEU . 5.8 mp -111.25 134.72 52.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.753 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.752 ' HG3' ' HA ' ' A' ' 29' ' ' MET . 0.5 OUTLIER -98.26 51.29 1.02 Allowed 'General case' 0 CA--C 1.502 -0.868 0 CA-C-O 121.389 0.614 . . . . 0.0 111.766 -179.385 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.677 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 38.8 tt0 0.33 117.85 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 114.118 -1.401 . . . . 0.0 111.187 -179.575 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.814 ' OD1' HG11 ' A' ' 76' ' ' VAL . 0.2 OUTLIER -46.87 115.14 3.17 Favored Pre-proline 0 C--N 1.305 -1.367 0 CA-C-N 114.186 -1.37 . . . . 0.0 112.188 -179.267 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -80.35 16.44 1.54 Allowed 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.822 2.348 . . . . 0.0 111.262 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.458 ' H ' HD21 ' A' ' 15' ' ' ASN . 9.1 t80 -125.04 -55.06 1.6 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.886 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.962 ' CD2' HG13 ' A' ' 70' ' ' VAL . 0.4 OUTLIER -73.71 -16.17 61.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.588 179.966 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.603 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 17.1 p -52.98 79.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.524 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.598 ' N ' ' O ' ' A' ' 18' ' ' PHE . 3.3 pt20 -104.03 167.61 9.79 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.145 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -61.17 63.08 0.1 OUTLIER 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.682 2.255 . . . . 0.0 111.683 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.553 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 147.91 -8.65 1.12 Allowed Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.391 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.537 ' HB3' ' HG2' ' A' ' 20' ' ' GLN . . . -147.68 102.95 3.68 Favored Pre-proline 0 CA--C 1.513 -0.442 0 CA-C-O 122.071 0.939 . . . . 0.0 111.996 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.603 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 90.7 Cg_endo -104.14 65.32 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.51 0 C-N-CA 124.923 3.749 . . . . 0.0 112.795 -178.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.29 ' CG2' HG21 ' A' ' 76' ' ' VAL . 34.3 mm -42.23 -177.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.083 0 CA-C-N 115.198 -0.91 . . . . 0.0 113.444 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.054 HD13 HD23 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -148.23 -155.77 0.66 Allowed 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -174.719 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.565 ' O ' ' NE2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER 159.93 67.17 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 113.143 -1.844 . . . . 0.0 111.478 179.569 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.754 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.1 OUTLIER 4.8 118.33 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 114.992 -1.004 . . . . 0.0 113.425 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.752 ' HA ' ' HG3' ' A' ' 13' ' ' GLN . 3.9 ttt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.481 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.605 ' O ' ' C ' ' A' ' 62' ' ' ALA . 23.8 t . . . . . 0 N--CA 1.456 -0.159 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.717 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 17.96 95.13 0.0 OUTLIER 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.889 -178.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.899 ' N ' ' O ' ' A' ' 81' ' ' ALA . 21.7 tttm -50.3 -32.84 18.04 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-O 121.648 0.737 . . . . 0.0 109.198 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.642 ' O ' ' N ' ' A' ' 80' ' ' THR . 12.7 m -147.37 105.14 3.71 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.039 179.197 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.817 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 2.9 p90 -91.04 164.63 13.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.486 0.66 . . . . 0.0 112.072 -179.041 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.707 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 3.5 t-20 -135.71 28.95 3.24 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 122.927 1.346 . . . . 0.0 107.823 177.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.516 ' CG ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -9.86 131.95 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 111.637 -2.529 . . . . 0.0 112.559 -179.48 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 1.058 HG21 ' CG1' ' A' ' 25' ' ' ILE . 14.0 m -139.36 52.24 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.323 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.686 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 50.7 m -24.62 118.3 0.05 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.564 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.962 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -115.92 -168.93 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.499 0.666 . . . . 0.0 112.316 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.568 ' SD ' ' CD2' ' A' ' 74' ' ' PHE . 1.1 mtp 30.44 -137.56 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.711 -1.131 . . . . 0.0 111.034 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -71.55 14.78 1.76 Allowed Glycine 0 N--CA 1.443 -0.833 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.624 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.552 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 123.92 36.78 0.61 Allowed Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.959 -0.639 . . . . 0.0 111.881 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.686 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.7 m-85 -75.16 118.3 17.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.961 0.41 . . . . 0.0 111.096 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.471 ' HB3' ' HD3' ' A' ' 67' ' ' ARG . 0.1 OUTLIER -98.71 124.12 43.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.478 0.656 . . . . 0.0 111.393 -179.526 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.29 HG21 ' CG2' ' A' ' 25' ' ' ILE . 27.1 m -117.69 11.67 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.308 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.201 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.817 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.4 OUTLIER 25.81 40.54 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 -177.124 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.73 ' N ' ' O ' ' A' ' 76' ' ' VAL . 33.6 t30 -2.97 69.53 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 113.528 -1.669 . . . . 0.0 109.26 -174.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.996 ' N ' HD12 ' A' ' 26' ' ' LEU . 40.5 m170 -39.54 120.02 1.03 Allowed 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 113.068 -1.878 . . . . 0.0 113.266 -177.266 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.642 ' N ' ' O ' ' A' ' 64' ' ' SER . 0.6 OUTLIER -112.52 -5.65 14.02 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 113.425 -1.716 . . . . 0.0 110.325 179.606 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.899 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -171.38 83.9 0.08 Allowed 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.278 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.57 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 1.2 m -80.52 127.99 33.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.73 0.3 . . . . 0.0 110.943 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.403 ' O ' ' CG ' ' A' ' 83' ' ' HIS . 22.3 p-80 . . . . . 0 C--N 1.333 -0.127 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.322 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.706 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 10.0 t . . . . . 0 CA--C 1.513 -0.449 0 CA-C-O 120.807 0.337 . . . . 0.0 110.495 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.912 HD23 HD13 ' A' ' 26' ' ' LEU . 6.5 mp -81.22 135.37 35.74 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.0 -179.294 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.652 ' O ' ' O ' ' A' ' 14' ' ' GLU . 54.6 mt-30 -118.33 57.53 0.85 Allowed 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.365 179.403 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.652 ' O ' ' O ' ' A' ' 13' ' ' GLN . 6.1 tt0 7.69 119.87 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.813 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.931 ' ND2' HG11 ' A' ' 76' ' ' VAL . 3.5 t-20 -39.22 128.03 1.3 Allowed Pre-proline 0 C--N 1.309 -1.167 0 CA-C-N 114.337 -1.302 . . . . 0.0 111.837 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.486 ' HD2' ' OD1' ' A' ' 15' ' ' ASN . 94.2 Cg_endo -85.22 31.95 0.48 Allowed 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.65 2.233 . . . . 0.0 111.167 178.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.521 ' CE2' ' HG3' ' A' ' 71' ' ' MET . 22.4 t80 -148.41 -55.75 0.21 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.634 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.869 ' CE2' HG13 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -70.76 -26.0 63.16 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.825 -1.079 . . . . 0.0 110.834 -179.51 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.675 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 35.9 t -50.92 81.09 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.944 -179.504 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.584 ' N ' ' O ' ' A' ' 18' ' ' PHE . 3.9 mm-40 -122.55 159.01 54.75 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.068 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -51.02 77.52 0.02 OUTLIER 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.748 2.299 . . . . 0.0 111.876 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 138.61 -18.63 3.21 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.601 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.504 ' O ' ' O ' ' A' ' 18' ' ' PHE . . . -147.11 102.76 3.82 Favored Pre-proline 0 CA--C 1.513 -0.475 0 CA-C-O 121.871 0.843 . . . . 0.0 111.782 -179.617 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.675 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 93.5 Cg_endo -105.89 64.49 0.02 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.564 0 C-N-CA 124.671 3.58 . . . . 0.0 113.603 -178.232 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.233 ' CG2' HG21 ' A' ' 76' ' ' VAL . 24.5 mm -43.4 -174.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.051 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.691 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.143 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -151.37 -161.67 1.38 Allowed 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 114.49 1.292 . . . . 0.0 114.49 -175.418 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.493 ' CB ' ' O ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER 159.72 83.51 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 112.809 -1.996 . . . . 0.0 110.9 179.104 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.706 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.0 OUTLIER -27.57 110.5 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.004 -179.405 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.589 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.7 mmt . . . . . 0 C--N 1.33 -0.246 0 CA-C-O 120.902 0.382 . . . . 0.0 111.161 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.575 ' O ' HG13 ' A' ' 61' ' ' VAL . 9.6 p . . . . . 0 N--CA 1.463 0.18 0 CA-C-O 120.697 0.284 . . . . 0.0 110.604 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.588 ' HA ' ' HA ' ' A' ' 82' ' ' CYS . . . 10.28 110.02 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.511 -179.526 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.884 ' N ' ' O ' ' A' ' 81' ' ' ALA . 8.2 ttmt -57.01 -42.96 81.3 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.611 0.72 . . . . 0.0 109.088 178.229 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.523 ' O ' ' N ' ' A' ' 80' ' ' THR . 16.9 m -141.03 128.75 21.57 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.523 -1.217 . . . . 0.0 109.095 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.748 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 4.8 p90 -114.73 157.52 23.07 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -178.157 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.945 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -125.3 27.97 6.45 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 122.615 1.198 . . . . 0.0 108.219 176.645 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.7 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 4.2 ptp180 -8.35 103.72 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 112.36 -2.2 . . . . 0.0 111.966 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 1.018 HG21 HG13 ' A' ' 25' ' ' ILE . 3.4 m -104.02 45.93 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.393 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.675 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 28.5 m -16.33 119.05 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.63 -178.818 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.869 HG13 ' CE2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -113.49 -162.8 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.691 179.94 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.521 ' HG3' ' CE2' ' A' ' 17' ' ' PHE . 6.0 mtp -29.13 151.58 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.208 -1.36 . . . . 0.0 111.907 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 43.7 23.87 0.39 Allowed Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.645 -0.788 . . . . 0.0 111.966 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.463 ' C ' HG23 ' A' ' 69' ' ' THR . . . 73.77 28.84 64.25 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.163 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.708 ' CB ' HG23 ' A' ' 70' ' ' VAL . 20.3 m-85 -43.81 170.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.65 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 22.3 mtmt -153.72 93.26 1.65 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.859 0.361 . . . . 0.0 111.318 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.233 HG21 ' CG2' ' A' ' 25' ' ' ILE . 18.6 m -93.0 15.73 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.489 -1.391 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.764 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.748 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 23.42 43.72 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 -177.691 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.945 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 12.9 t-20 1.55 75.52 0.0 OUTLIER 'General case' 0 CA--C 1.499 -1.005 0 CA-C-N 114.519 -1.219 . . . . 0.0 108.043 -175.02 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 1.143 ' N ' HD12 ' A' ' 26' ' ' LEU . 33.6 m170 -49.19 99.58 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.419 0 CA-C-O 122.61 1.195 . . . . 0.0 111.669 -176.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.711 HG23 ' O ' ' A' ' 78' ' ' ASN . 2.8 p -92.07 -3.5 55.66 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.55 -1.659 . . . . 0.0 109.71 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.884 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -174.33 126.75 0.34 Allowed 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.5 OUTLIER -121.47 127.91 51.56 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.987 0.422 . . . . 0.0 111.281 -179.21 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.788 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.709 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 4.8 t . . . . . 0 CA--C 1.515 -0.387 0 CA-C-O 121.159 0.504 . . . . 0.0 111.021 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.864 HD23 HD13 ' A' ' 26' ' ' LEU . 8.2 mp -75.28 126.34 30.81 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.925 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.586 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.9 mt-30 -104.16 52.81 0.75 Allowed 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.948 179.306 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.645 ' HG3' ' HB2' ' A' ' 24' ' ' PRO . 2.1 tt0 -1.16 121.87 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.159 -1.837 . . . . 0.0 111.401 -178.773 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.735 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.4 OUTLIER -58.68 102.06 0.28 Allowed Pre-proline 0 C--N 1.307 -1.247 0 CA-C-N 114.348 -1.296 . . . . 0.0 112.565 -179.101 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.522 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 2.8 Cg_exo -73.45 2.37 5.8 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.267 1.978 . . . . 0.0 109.084 177.321 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.527 ' CE1' ' SD ' ' A' ' 71' ' ' MET . 2.1 t80 -93.3 -60.69 1.73 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 113.557 -1.656 . . . . 0.0 110.287 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.866 ' CD1' HG21 ' A' ' 70' ' ' VAL . 12.6 m-85 -81.35 -5.79 58.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.044 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.512 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -52.81 89.15 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.51 179.72 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.553 ' CB ' ' CD ' ' A' ' 21' ' ' PRO . 5.3 pt20 -96.55 -176.38 0.53 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.818 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.553 ' CD ' ' CB ' ' A' ' 20' ' ' GLN . 2.9 Cg_endo -73.86 60.63 4.51 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.522 2.148 . . . . 0.0 111.402 179.422 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 143.12 3.35 0.9 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.661 -0.78 . . . . 0.0 113.263 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.471 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -154.56 105.82 2.36 Favored Pre-proline 0 CA--C 1.514 -0.405 0 CA-C-O 121.894 0.854 . . . . 0.0 111.808 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.661 ' O ' ' O ' ' A' ' 25' ' ' ILE . 66.6 Cg_endo -103.4 73.08 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.392 0 C-N-CA 124.77 3.647 . . . . 0.0 113.004 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.162 ' CG2' HG21 ' A' ' 76' ' ' VAL . 6.7 mm -38.52 -177.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.885 ' N ' HG22 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -151.21 -163.66 1.82 Allowed 'General case' 0 CA--C 1.499 -1.013 0 CA-C-O 122.851 1.31 . . . . 0.0 114.262 -175.981 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.558 ' CG ' ' O ' ' A' ' 27' ' ' GLN . 0.3 OUTLIER 166.27 66.49 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 112.363 -2.198 . . . . 0.0 110.836 179.331 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.709 ' HA ' ' O ' ' A' ' 11' ' ' THR . 3.9 t -24.73 109.26 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.223 -179.545 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.52 ' HG2' ' OE1' ' A' ' 13' ' ' GLN . 3.4 ttm . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.078 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.661 ' O ' HG12 ' A' ' 61' ' ' VAL . 40.1 t . . . . . 0 N--CA 1.461 0.078 0 CA-C-O 120.763 0.316 . . . . 0.0 110.979 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.692 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 16.83 112.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.634 ' N ' ' O ' ' A' ' 81' ' ' ALA . 20.2 ttmt -54.16 -33.61 58.41 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.652 ' O ' ' HB1' ' A' ' 62' ' ' ALA . 1.8 m -137.27 -175.32 4.02 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.964 178.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.69 ' HB3' ' HB3' ' A' ' 77' ' ' GLU . 1.0 OUTLIER -164.6 162.06 21.34 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.288 0.566 . . . . 0.0 111.588 -179.77 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.674 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -132.54 27.66 4.36 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.194 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.6 ' HG3' ' HA ' ' A' ' 77' ' ' GLU . 2.4 ttm105 -8.05 121.4 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 112.284 -2.235 . . . . 0.0 111.311 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 1.069 HG13 ' HB2' ' A' ' 78' ' ' ASN . 4.3 m -123.72 43.62 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.803 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.653 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 54.5 m -17.82 118.35 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.764 -178.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.866 HG21 ' CD1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -122.25 -169.79 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.485 -179.054 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.632 ' HG3' ' CG ' ' A' ' 74' ' ' PHE . 0.1 OUTLIER 41.54 -140.09 0.12 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.368 -179.59 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -70.63 0.34 27.68 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.811 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.431 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 136.11 40.94 0.13 Allowed Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.525 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.675 ' C ' ' HG2' ' A' ' 75' ' ' LYS . 2.4 m-85 -69.41 -179.33 1.62 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.675 ' HG2' ' C ' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -157.45 97.58 1.62 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.984 0.365 . . . . 0.0 111.984 -179.466 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.162 HG21 ' CG2' ' A' ' 25' ' ' ILE . 16.3 m -91.62 11.93 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.42 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.013 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.755 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 29.22 39.56 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 105.083 -2.192 . . . . 0.0 105.083 -176.601 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 1.069 ' HB2' HG13 ' A' ' 68' ' ' VAL . 32.7 t30 -0.14 65.45 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 112.816 -1.993 . . . . 0.0 108.378 -174.561 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.881 ' O ' HD13 ' A' ' 26' ' ' LEU . 37.8 m170 -34.46 123.58 0.52 Allowed 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 112.703 -2.044 . . . . 0.0 113.43 -176.711 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.492 ' OG1' ' HB3' ' A' ' 64' ' ' SER . 6.5 p -110.78 -15.14 13.88 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 113.471 -1.695 . . . . 0.0 110.426 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.634 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -161.87 147.65 13.47 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.888 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.5 OUTLIER -127.27 154.55 44.75 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.904 0.383 . . . . 0.0 111.227 -179.98 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.943 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.689 ' O ' ' N ' ' A' ' 29' ' ' MET . 3.3 t . . . . . 0 CA--C 1.512 -0.489 0 CA-C-O 121.101 0.477 . . . . 0.0 110.37 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.853 HD23 HD13 ' A' ' 26' ' ' LEU . 7.8 mp -75.74 133.66 40.68 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.274 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.713 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.7 mt-30 -120.75 65.12 0.85 Allowed 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 121.636 0.731 . . . . 0.0 110.977 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.713 ' O ' ' O ' ' A' ' 13' ' ' GLN . 18.2 tt0 2.91 127.22 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 113.566 -1.652 . . . . 0.0 111.903 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.884 ' ND2' ' CZ ' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -56.19 108.82 1.32 Allowed Pre-proline 0 C--N 1.307 -1.28 0 CA-C-N 113.858 -1.519 . . . . 0.0 113.339 -178.949 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.755 ' HD2' ' CE1' ' A' ' 17' ' ' PHE . 9.9 Cg_exo -69.95 4.95 1.97 Allowed 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.508 2.139 . . . . 0.0 112.042 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.884 ' CZ ' ' ND2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -114.12 -56.16 2.42 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.394 178.674 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 1.187 ' CD2' HG13 ' A' ' 70' ' ' VAL . 0.3 OUTLIER -78.97 -5.58 54.18 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.888 -178.751 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.468 ' CB ' ' O ' ' A' ' 15' ' ' ASN . 2.2 t -64.91 95.28 0.15 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.746 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.575 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.1 OUTLIER -135.84 144.74 49.92 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.857 -179.649 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.563 ' CD ' ' HG3' ' A' ' 20' ' ' GLN . 1.3 Cg_endo -45.1 82.91 0.01 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.7 2.267 . . . . 0.0 111.343 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.575 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 138.35 -15.87 3.41 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.73 -179.088 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.444 ' O ' ' O ' ' A' ' 18' ' ' PHE . . . -153.95 100.28 2.53 Favored Pre-proline 0 CA--C 1.51 -0.587 0 CA-C-O 121.958 0.885 . . . . 0.0 111.094 179.731 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.662 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.1 Cg_endo -103.26 60.33 0.02 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.588 0 C-N-CA 124.643 3.562 . . . . 0.0 112.78 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.226 ' CG2' HG21 ' A' ' 76' ' ' VAL . 23.1 mm -40.25 -176.69 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.141 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.876 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.994 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -148.87 -160.16 1.13 Allowed 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -175.105 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.466 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER 161.8 98.17 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 112.376 -2.193 . . . . 0.0 109.723 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.649 ' SG ' HD12 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -48.29 103.65 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.492 -0.777 . . . . 0.0 111.711 -178.531 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.689 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.47 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.624 ' O ' ' C ' ' A' ' 62' ' ' ALA . 47.8 t . . . . . 0 N--CA 1.456 -0.131 0 CA-C-O 120.559 0.219 . . . . 0.0 110.713 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.624 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 0.3 103.36 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.696 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.791 ' N ' ' O ' ' A' ' 81' ' ' ALA . 1.6 ttmm -54.84 -38.74 67.81 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.545 ' O ' ' N ' ' A' ' 80' ' ' THR . 15.5 m -140.94 117.0 10.52 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.779 -1.101 . . . . 0.0 109.717 178.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.752 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 2.8 p90 -107.57 161.99 14.36 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.283 -178.469 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.82 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 1.0 OUTLIER -129.69 28.13 5.16 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 122.357 1.075 . . . . 0.0 108.173 177.11 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.744 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -11.85 115.81 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 112.565 -2.107 . . . . 0.0 111.734 -179.899 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 1.044 HG21 HG13 ' A' ' 25' ' ' ILE . 3.8 m -120.14 48.12 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 114.867 -1.06 . . . . 0.0 110.737 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.637 ' C ' ' O ' ' A' ' 68' ' ' VAL . 5.8 m -14.05 118.84 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.079 -179.062 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 1.187 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -107.52 -162.42 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.799 0.809 . . . . 0.0 111.729 -179.8 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.539 ' O ' ' CD1' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -32.66 151.45 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.929 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 48.01 19.23 0.95 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.15 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.58 ' C ' HG23 ' A' ' 69' ' ' THR . . . 70.82 30.26 68.41 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.303 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.587 ' O ' ' HA ' ' A' ' 69' ' ' THR . 5.8 m-30 -51.67 -174.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.803 0.335 . . . . 0.0 111.007 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -158.97 121.05 3.49 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.274 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.226 HG21 ' CG2' ' A' ' 25' ' ' ILE . 19.6 m -118.18 12.08 7.11 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.494 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.437 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.752 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 28.26 39.71 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 -177.05 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.919 ' HB2' HG13 ' A' ' 68' ' ' VAL . 49.2 t30 -0.8 68.49 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.899 0 CA-C-N 113.531 -1.668 . . . . 0.0 108.55 -174.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.994 ' N ' HD12 ' A' ' 26' ' ' LEU . 39.4 m170 -39.48 118.01 0.78 Allowed 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 113.198 -1.819 . . . . 0.0 114.1 -176.442 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.545 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.0 OUTLIER -109.12 -17.01 13.98 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 113.379 -1.737 . . . . 0.0 109.487 178.792 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.791 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -162.88 136.93 6.19 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.263 -0.88 . . . . 0.0 108.942 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -125.9 140.98 52.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.706 0.289 . . . . 0.0 110.636 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.331 -0.216 0 CA-C-O 120.98 0.419 . . . . 0.0 111.502 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.678 ' O ' HD12 ' A' ' 12' ' ' LEU . 1.0 OUTLIER . . . . . 0 N--CA 1.456 -0.139 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.846 HD23 HD13 ' A' ' 26' ' ' LEU . 6.1 mp -122.27 138.19 54.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.154 0.502 . . . . 0.0 111.093 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.63 ' O ' ' C ' ' A' ' 14' ' ' GLU . 2.3 mt-30 -96.15 44.97 1.07 Allowed 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.197 -179.593 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.66 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 21.8 tt0 -2.53 116.63 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 114.143 -1.389 . . . . 0.0 110.66 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.746 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.9 OUTLIER -56.03 103.1 0.34 Allowed Pre-proline 0 C--N 1.304 -1.4 0 CA-C-N 114.223 -1.353 . . . . 0.0 112.367 -178.8 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.553 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 72.6 Cg_endo -75.37 10.27 1.89 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.247 1.965 . . . . 0.0 109.887 177.705 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.576 ' CZ ' ' SD ' ' A' ' 71' ' ' MET . 0.8 OUTLIER -106.06 -59.55 1.76 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.212 -1.358 . . . . 0.0 110.879 -179.478 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.768 ' HD2' HG21 ' A' ' 25' ' ' ILE . 8.8 m-85 -80.34 -1.71 42.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.822 -179.032 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.464 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 27.4 t -48.94 93.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.841 0.353 . . . . 0.0 110.179 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.543 ' O ' ' N ' ' A' ' 22' ' ' GLY . 2.8 mt-30 -91.43 168.38 13.56 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.921 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.417 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 27.2 Cg_exo -62.55 59.69 0.14 Allowed 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.708 2.272 . . . . 0.0 111.462 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.543 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 138.62 5.21 1.51 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.898 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.419 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -150.98 101.69 3.02 Favored Pre-proline 0 CA--C 1.511 -0.543 0 CA-C-O 122.082 0.944 . . . . 0.0 111.938 -179.612 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.587 ' O ' ' O ' ' A' ' 25' ' ' ILE . 18.6 Cg_endo -96.17 81.24 0.1 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.464 0 C-N-CA 124.504 3.469 . . . . 0.0 112.708 -179.279 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.244 ' CG2' HG21 ' A' ' 76' ' ' VAL . 12.6 mm -42.01 -175.59 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.95 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -153.72 -160.37 1.1 Allowed 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 -175.229 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.539 ' O ' ' O ' ' A' ' 28' ' ' CYS . 1.8 tt0 162.53 64.06 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 112.523 -2.126 . . . . 0.0 111.429 179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.647 ' HB2' ' CE1' ' A' ' 79' ' ' HIS . 0.6 OUTLIER 6.91 121.0 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 179.772 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.612 ' HA ' ' HG3' ' A' ' 13' ' ' GLN . 3.2 ttp . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.904 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.766 ' O ' HG12 ' A' ' 61' ' ' VAL . 73.2 t . . . . . 0 N--CA 1.456 -0.149 0 CA-C-O 121.021 0.438 . . . . 0.0 110.027 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.575 ' HA ' ' HA ' ' A' ' 82' ' ' CYS . . . 31.87 103.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.891 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.768 ' N ' ' O ' ' A' ' 81' ' ' ALA . 3.1 tptt -51.92 -36.33 48.63 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.706 0.765 . . . . 0.0 109.23 178.601 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.612 ' O ' ' N ' ' A' ' 80' ' ' THR . 74.9 m -150.08 118.84 6.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.39 -1.277 . . . . 0.0 109.919 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.846 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -105.23 166.31 10.5 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.531 0.681 . . . . 0.0 112.293 -178.811 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.793 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 0.1 OUTLIER -130.9 27.09 4.93 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-O 122.593 1.187 . . . . 0.0 107.921 177.399 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.686 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 12.9 ptt85 -11.0 100.7 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 112.475 -2.148 . . . . 0.0 111.689 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 1.015 HG13 ' HB2' ' A' ' 78' ' ' ASN . 4.2 m -98.32 45.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 CA-C-N 114.939 -1.028 . . . . 0.0 110.502 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.67 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 53.0 m -21.52 118.9 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.027 -179.356 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.831 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.2 OUTLIER -126.12 -167.49 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.784 0.802 . . . . 0.0 112.474 -178.457 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.658 ' H ' HG12 ' A' ' 70' ' ' VAL . 0.0 OUTLIER 39.17 -132.73 0.18 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.969 -179.888 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -78.97 19.65 5.13 Favored Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.735 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 113.06 41.43 0.98 Allowed Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.634 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.67 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.2 m-85 -72.53 178.6 3.96 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.604 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 5.9 mtmm -155.14 108.23 2.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.193 0.521 . . . . 0.0 111.454 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.244 HG21 ' CG2' ' A' ' 25' ' ' ILE . 15.4 m -106.59 15.02 7.52 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.483 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.337 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.846 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.6 OUTLIER 28.41 40.21 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 105.787 -1.931 . . . . 0.0 105.787 -176.876 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 1.015 ' HB2' HG13 ' A' ' 68' ' ' VAL . 29.1 t30 -4.89 68.92 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 113.402 -1.726 . . . . 0.0 108.722 -174.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.95 ' N ' HD12 ' A' ' 26' ' ' LEU . 36.4 m170 -37.77 122.11 0.95 Allowed 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 112.945 -1.934 . . . . 0.0 113.909 -176.594 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.612 ' N ' ' O ' ' A' ' 64' ' ' SER . 2.1 p -109.12 -11.73 14.9 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 113.048 -1.887 . . . . 0.0 109.211 178.518 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.768 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -172.38 142.49 1.31 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.4 179.01 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 8.1 m -120.82 146.22 46.78 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.679 0.276 . . . . 0.0 110.494 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.331 -0.224 0 CA-C-O 120.816 0.341 . . . . 0.0 111.8 -179.061 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.629 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 3.9 t . . . . . 0 CA--C 1.516 -0.36 0 CA-C-O 121.183 0.516 . . . . 0.0 111.106 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.108 ' CD2' HD13 ' A' ' 26' ' ' LEU . 8.0 mp -85.9 130.31 34.58 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.465 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.614 ' O ' ' C ' ' A' ' 14' ' ' GLU . 2.0 mt-30 -91.39 49.01 1.54 Allowed 'General case' 0 CA--C 1.5 -0.95 0 CA-C-O 121.905 0.86 . . . . 0.0 110.278 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.614 ' C ' ' O ' ' A' ' 13' ' ' GLN . 27.5 tt0 -1.15 113.81 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 113.339 -1.755 . . . . 0.0 110.864 -178.575 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.925 ' ND2' HG11 ' A' ' 76' ' ' VAL . 1.4 t-20 -41.0 100.69 0.23 Allowed Pre-proline 0 C--N 1.301 -1.528 0 CA-C-N 113.293 -1.776 . . . . 0.0 112.349 -179.191 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -68.74 4.83 1.56 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.272 1.981 . . . . 0.0 110.664 178.42 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.586 ' CZ ' ' HG3' ' A' ' 71' ' ' MET . 10.9 t80 -110.63 -56.47 2.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.965 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.939 ' CE2' HG13 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -73.16 -26.53 61.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.535 179.777 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.531 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 8.9 m -47.26 97.57 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.928 -179.652 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.627 ' O ' ' N ' ' A' ' 22' ' ' GLY . 8.7 tt0 -136.04 139.7 31.01 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.443 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.485 ' HD2' ' HG3' ' A' ' 20' ' ' GLN . 87.9 Cg_exo -35.36 81.84 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.747 2.298 . . . . 0.0 112.417 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.627 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 130.93 -6.32 5.76 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.503 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.456 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . -159.73 101.65 1.47 Allowed Pre-proline 0 CA--C 1.513 -0.463 0 CA-C-O 121.992 0.901 . . . . 0.0 111.862 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.641 ' O ' ' O ' ' A' ' 25' ' ' ILE . 91.6 Cg_endo -106.24 65.94 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.506 0 C-N-CA 124.981 3.787 . . . . 0.0 113.469 -178.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.195 ' CG2' HG21 ' A' ' 76' ' ' VAL . 16.2 mm -41.81 -176.41 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.368 179.172 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.108 HD13 ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -150.62 -160.52 1.18 Allowed 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -175.403 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.586 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 17.5 tt0 166.25 63.01 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 112.706 -2.043 . . . . 0.0 110.998 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.643 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 94.3 m -20.1 111.73 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.733 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.55 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.927 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.518 ' O ' ' C ' ' A' ' 62' ' ' ALA . 18.0 t . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.974 0.416 . . . . 0.0 110.342 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.739 ' HB1' ' O ' ' A' ' 64' ' ' SER . . . 13.0 99.65 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -179.264 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.925 ' N ' ' O ' ' A' ' 81' ' ' ALA . 0.9 OUTLIER -50.29 -35.24 26.5 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.307 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.739 ' O ' ' HB1' ' A' ' 62' ' ' ALA . 22.6 m -136.28 -174.88 3.81 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 113.768 -1.56 . . . . 0.0 108.877 179.164 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.723 ' HB3' ' HB3' ' A' ' 77' ' ' GLU . 1.8 p90 -164.05 162.97 23.38 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.498 0.666 . . . . 0.0 112.331 -179.531 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.827 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -134.99 29.36 3.43 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 176.468 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.736 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 1.8 ptt85 -10.76 130.0 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 112.109 -2.314 . . . . 0.0 112.368 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 1.013 HG21 HG13 ' A' ' 25' ' ' ILE . 2.5 m -135.28 38.2 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.094 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.586 ' C ' ' O ' ' A' ' 68' ' ' VAL . 23.1 m -4.5 119.23 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.661 -1.154 . . . . 0.0 112.336 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.939 HG13 ' CE2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -111.16 -161.29 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-O 121.78 0.8 . . . . 0.0 111.593 179.108 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.586 ' HG3' ' CZ ' ' A' ' 17' ' ' PHE . 3.7 mtt -30.89 153.6 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.901 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 42.13 25.85 0.29 Allowed Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.46 -0.876 . . . . 0.0 111.552 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.503 ' C ' HG23 ' A' ' 69' ' ' THR . . . 68.96 30.82 72.22 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.128 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.586 ' HB2' HG23 ' A' ' 70' ' ' VAL . 8.0 m-30 -46.59 179.36 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.625 0.25 . . . . 0.0 110.331 179.733 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.53 ' CG ' ' O ' ' A' ' 74' ' ' PHE . 9.7 mtpt -161.58 93.0 0.9 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.133 0.492 . . . . 0.0 111.432 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.195 HG21 ' CG2' ' A' ' 25' ' ' ILE . 27.3 m -85.82 9.1 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.486 -1.488 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.903 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.738 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 29.49 39.62 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 -177.084 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.857 ' HB2' HG13 ' A' ' 68' ' ' VAL . 61.3 t30 3.91 62.15 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 113.123 -1.853 . . . . 0.0 108.448 -174.688 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 1.042 ' O ' HD21 ' A' ' 12' ' ' LEU . 35.7 m170 -31.7 120.95 0.27 Allowed 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 112.778 -2.01 . . . . 0.0 113.7 -176.742 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.501 ' OG1' ' HB2' ' A' ' 64' ' ' SER . 7.5 p -107.7 -10.88 15.53 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 113.84 -1.527 . . . . 0.0 110.1 179.424 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.925 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -170.44 133.03 1.02 Allowed 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.908 178.775 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.594 ' SG ' ' CD1' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -116.67 142.38 46.97 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.27 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.469 ' CG ' ' O ' ' A' ' 83' ' ' HIS . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-O 120.816 0.341 . . . . 0.0 110.828 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.637 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 3.7 t . . . . . 0 CA--C 1.515 -0.382 0 CA-C-O 120.705 0.288 . . . . 0.0 110.419 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.023 HD23 HD13 ' A' ' 26' ' ' LEU . 3.9 mp -97.2 139.21 33.51 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.392 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.634 ' O ' ' O ' ' A' ' 14' ' ' GLU . 28.7 mt-30 -111.24 55.04 0.66 Allowed 'General case' 0 CA--C 1.505 -0.752 0 CA-C-O 121.658 0.742 . . . . 0.0 110.736 179.093 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.634 ' O ' ' O ' ' A' ' 13' ' ' GLN . 14.7 tt0 -0.16 122.63 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 113.651 -1.613 . . . . 0.0 111.311 -179.555 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.802 ' HB2' HG22 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -63.46 102.69 0.34 Allowed Pre-proline 0 C--N 1.305 -1.341 0 CA-C-N 114.107 -1.406 . . . . 0.0 112.7 -179.015 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.537 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 6.3 Cg_exo -76.72 5.09 5.08 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.632 2.221 . . . . 0.0 109.41 177.429 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.525 ' HB3' ' OD1' ' A' ' 15' ' ' ASN . 0.9 OUTLIER -96.85 -62.28 1.28 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 113.86 -1.518 . . . . 0.0 110.525 -179.668 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 1.132 ' CG ' HG21 ' A' ' 70' ' ' VAL . 7.3 m-85 -77.76 -4.86 48.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.86 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.488 ' HA ' ' O ' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -52.23 91.52 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.127 179.477 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.673 ' O ' ' N ' ' A' ' 22' ' ' GLY . 4.6 mt-30 -95.09 162.59 24.39 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.357 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.573 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 11.4 Cg_endo -54.86 63.48 0.03 OUTLIER 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.761 2.307 . . . . 0.0 111.802 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.673 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 143.53 1.08 1.07 Allowed Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.805 -0.712 . . . . 0.0 113.133 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.504 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -155.13 108.61 2.27 Favored Pre-proline 0 CA--C 1.518 -0.258 0 CA-C-O 122.074 0.94 . . . . 0.0 112.804 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.559 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 94.9 Cg_endo -98.78 78.52 0.05 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.073 0 C-N-CA 124.844 3.696 . . . . 0.0 112.913 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.23 ' CG2' HG21 ' A' ' 76' ' ' VAL . 5.1 mm -43.9 -176.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.026 HD23 ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.21 -164.87 2.07 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 122.343 1.068 . . . . 0.0 113.612 -176.297 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.662 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER 165.55 78.87 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 112.939 -1.937 . . . . 0.0 111.051 178.868 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.637 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -13.35 114.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.265 -179.851 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.591 ' HB2' ' CG ' ' A' ' 13' ' ' GLN . 9.8 mmm . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 120.885 0.374 . . . . 0.0 111.241 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.539 ' O ' HG12 ' A' ' 61' ' ' VAL . 61.0 t . . . . . 0 C--O 1.23 0.053 0 CA-C-O 120.723 0.297 . . . . 0.0 110.738 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.58 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 21.15 103.43 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.992 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.86 ' N ' ' O ' ' A' ' 81' ' ' ALA . 15.1 tttt -54.18 -35.67 62.58 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.538 0.685 . . . . 0.0 109.335 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.537 ' O ' ' N ' ' A' ' 80' ' ' THR . 37.1 m -146.3 127.41 14.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.379 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.854 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -112.31 166.11 11.58 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.594 0.711 . . . . 0.0 112.576 -178.343 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.715 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -133.1 29.52 4.04 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 114.612 -1.176 . . . . 0.0 108.198 177.393 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.737 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.8 OUTLIER -16.13 125.31 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 112.426 -2.17 . . . . 0.0 111.6 -179.718 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.936 HG21 ' CD1' ' A' ' 25' ' ' ILE . 2.7 m -128.57 41.92 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.328 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.65 ' C ' ' O ' ' A' ' 68' ' ' VAL . 55.0 m -9.75 118.35 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.665 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 1.132 HG21 ' CG ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -124.45 -171.1 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 121.52 0.676 . . . . 0.0 111.962 -178.765 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.476 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 42.6 mmm 34.3 -127.65 0.08 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.829 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -81.69 26.27 3.69 Favored Glycine 0 N--CA 1.44 -1.057 0 CA-C-N 115.498 -0.774 . . . . 0.0 112.566 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.607 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 104.69 43.02 1.74 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.468 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.612 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.0 m-85 -85.79 116.1 23.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.811 0.339 . . . . 0.0 111.011 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -99.65 104.5 16.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.121 0.486 . . . . 0.0 112.243 -179.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.23 HG21 ' CG2' ' A' ' 25' ' ' ILE . 12.6 m -92.32 14.64 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.361 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.755 178.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.854 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 29.18 39.94 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 105.508 -2.034 . . . . 0.0 105.508 -176.426 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.724 ' HB2' HG13 ' A' ' 68' ' ' VAL . 46.6 t30 -2.2 67.9 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.828 0 CA-C-N 113.245 -1.798 . . . . 0.0 108.53 -175.204 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 1.025 ' N ' HD12 ' A' ' 26' ' ' LEU . 37.6 m170 -35.49 120.48 0.56 Allowed 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 113.264 -1.789 . . . . 0.0 113.877 -176.232 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.537 ' N ' ' O ' ' A' ' 64' ' ' SER . 3.9 p -111.16 -11.16 14.27 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 113.514 -1.675 . . . . 0.0 110.233 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.86 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -168.83 133.4 1.54 Allowed 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.586 ' SG ' HD11 ' A' ' 12' ' ' LEU . 1.3 m -119.74 137.16 54.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.919 0.39 . . . . 0.0 111.077 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.9 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.75 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 1.7 t . . . . . 0 CA--C 1.517 -0.29 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.055 HD21 ' O ' ' A' ' 79' ' ' HIS . 6.8 mp -98.32 138.69 35.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.015 0.436 . . . . 0.0 111.812 -179.222 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.707 ' O ' ' O ' ' A' ' 14' ' ' GLU . 20.2 mt-30 -115.14 52.28 0.87 Allowed 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 121.713 0.768 . . . . 0.0 110.79 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.707 ' O ' ' O ' ' A' ' 13' ' ' GLN . 8.3 tt0 7.7 126.35 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 113.327 -1.76 . . . . 0.0 112.336 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.8 ' OD1' HG11 ' A' ' 76' ' ' VAL . 0.0 OUTLIER -53.81 108.74 1.2 Allowed Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.249 179.616 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -74.12 20.71 0.4 Allowed 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.22 1.947 . . . . 0.0 111.727 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.622 ' CZ ' ' HG2' ' A' ' 71' ' ' MET . 34.8 t80 -128.34 -55.4 1.25 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.58 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 1.023 ' CD2' HG13 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -71.69 -24.34 61.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.685 -179.772 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.664 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.2 m -40.03 92.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.182 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.607 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -124.29 138.89 31.68 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.592 -179.394 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.508 ' N ' ' OE1' ' A' ' 20' ' ' GLN . 83.4 Cg_exo -37.41 83.67 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.534 2.156 . . . . 0.0 112.08 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.607 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 127.37 -9.59 6.94 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.537 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.456 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -154.75 99.48 2.41 Favored Pre-proline 0 CA--C 1.512 -0.508 0 CA-C-O 122.011 0.91 . . . . 0.0 111.486 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.7 ' O ' ' O ' ' A' ' 25' ' ' ILE . 71.7 Cg_endo -103.63 66.67 0.03 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.57 0 C-N-CA 124.954 3.769 . . . . 0.0 112.608 -178.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.198 ' CG2' HG21 ' A' ' 76' ' ' VAL . 25.1 mm -37.59 -178.03 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.002 0 CA-C-N 115.322 -0.853 . . . . 0.0 113.284 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.922 HD13 ' O ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -153.78 -159.57 0.99 Allowed 'General case' 0 CA--C 1.498 -1.054 0 CA-C-O 122.726 1.25 . . . . 0.0 114.193 -175.343 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.598 ' O ' ' C ' ' A' ' 28' ' ' CYS . 3.4 tt0 168.58 65.85 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 112.716 -2.038 . . . . 0.0 111.297 179.13 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.75 ' HA ' ' O ' ' A' ' 11' ' ' THR . 68.0 m -5.98 113.04 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.935 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.616 ' N ' ' O ' ' A' ' 11' ' ' THR . 3.3 tpp . . . . . 0 C--N 1.326 -0.444 0 CA-C-O 120.84 0.352 . . . . 0.0 111.226 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.583 ' O ' HG12 ' A' ' 61' ' ' VAL . 32.5 t . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.975 0.416 . . . . 0.0 111.478 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.712 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 40.23 114.49 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.661 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.753 ' N ' ' O ' ' A' ' 81' ' ' ALA . 13.1 tttm -56.08 -37.1 68.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.52 0.676 . . . . 0.0 109.179 178.012 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.648 ' O ' ' N ' ' A' ' 80' ' ' THR . 70.7 m -143.71 117.51 9.31 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.379 179.368 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.751 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 2.5 p90 -106.35 162.4 13.71 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.245 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.847 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -132.95 27.82 4.22 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 107.613 -1.255 . . . . 0.0 107.613 176.67 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.682 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.2 OUTLIER -6.64 129.69 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 112.201 -2.272 . . . . 0.0 112.522 -179.424 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 1.084 HG21 ' CD1' ' A' ' 25' ' ' ILE . 4.9 m -138.76 53.31 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 114.585 -1.188 . . . . 0.0 110.302 179.573 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.657 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 17.7 m -24.91 118.22 0.05 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.182 0.515 . . . . 0.0 111.466 -178.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 1.023 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -109.82 -171.21 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.283 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.622 ' HG2' ' CZ ' ' A' ' 17' ' ' PHE . 3.0 mtp 30.23 -149.68 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.51 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.478 ' H ' ' HB3' ' A' ' 71' ' ' MET . . . -46.76 -20.39 0.65 Allowed Glycine 0 N--CA 1.438 -1.181 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.822 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.64 ' C ' HG23 ' A' ' 69' ' ' THR . . . 152.78 32.41 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.665 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.657 ' O ' ' HA ' ' A' ' 69' ' ' THR . 9.1 m-30 -53.09 179.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.53 0.205 . . . . 0.0 110.81 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.569 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -155.0 103.4 2.39 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.883 0.373 . . . . 0.0 111.184 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.198 HG21 ' CG2' ' A' ' 25' ' ' ILE . 27.4 m -100.49 10.94 7.19 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.034 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.751 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 27.87 40.35 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 105.384 -2.08 . . . . 0.0 105.384 -177.092 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.929 ' HB2' HG13 ' A' ' 68' ' ' VAL . 48.0 t30 3.26 64.58 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 113.253 -1.794 . . . . 0.0 108.593 -174.022 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 1.055 ' O ' HD21 ' A' ' 12' ' ' LEU . 37.8 m170 -38.07 120.4 0.86 Allowed 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 112.779 -2.01 . . . . 0.0 113.154 -176.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.648 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.0 OUTLIER -110.19 -7.52 14.86 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 113.533 -1.667 . . . . 0.0 109.466 179.455 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.753 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -173.76 142.2 0.89 Allowed 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.253 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.658 ' SG ' HD12 ' A' ' 12' ' ' LEU . 3.2 m -115.93 163.13 16.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.305 0.574 . . . . 0.0 111.457 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.519 ' CG ' ' O ' ' A' ' 83' ' ' HIS . 26.4 p-80 . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.128 179.034 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.716 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 0.6 OUTLIER . . . . . 0 CA--C 1.517 -0.311 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.793 HD21 ' CB ' ' A' ' 79' ' ' HIS . 10.8 mp -90.2 128.37 36.35 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.164 0.507 . . . . 0.0 111.59 -179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.619 ' O ' ' C ' ' A' ' 14' ' ' GLU . 5.0 mt-30 -96.52 46.96 1.06 Allowed 'General case' 0 CA--C 1.502 -0.867 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.775 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.79 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -0.29 117.1 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 113.775 -1.557 . . . . 0.0 110.797 -179.138 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.778 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.7 OUTLIER -54.88 101.96 0.28 Allowed Pre-proline 0 C--N 1.31 -1.119 0 CA-C-N 114.552 -1.204 . . . . 0.0 112.413 -178.637 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.592 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 61.8 Cg_endo -73.67 7.41 2.34 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 122.091 1.861 . . . . 0.0 110.003 177.736 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.54 ' HB3' ' OD1' ' A' ' 15' ' ' ASN . 1.5 t80 -102.81 -60.7 1.5 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.191 -1.368 . . . . 0.0 110.102 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.925 ' HD2' HG21 ' A' ' 25' ' ' ILE . 3.2 m-85 -82.93 3.76 28.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.459 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.833 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 15.0 t -64.07 99.11 0.24 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.558 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.627 ' N ' ' O ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -102.26 170.33 6.5 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.991 179.046 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.503 ' HD2' ' CB ' ' A' ' 20' ' ' GLN . 14.7 Cg_endo -57.45 73.12 0.04 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 122.454 2.103 . . . . 0.0 111.94 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.535 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 133.79 -9.61 4.89 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.359 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.627 ' O ' ' N ' ' A' ' 20' ' ' GLN . . . -146.12 104.0 4.11 Favored Pre-proline 0 CA--C 1.509 -0.6 0 CA-C-O 121.81 0.815 . . . . 0.0 111.247 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.864 ' O ' ' O ' ' A' ' 25' ' ' ILE . 78.3 Cg_endo -97.06 25.39 0.25 Allowed 'Trans proline' 0 N--CA 1.449 -1.133 0 C-N-CA 124.46 3.44 . . . . 0.0 113.477 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.176 ' CG2' HG21 ' A' ' 76' ' ' VAL . 10.7 mm 21.94 -175.03 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 114.932 -1.031 . . . . 0.0 112.843 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.968 ' H ' HG22 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -158.76 -166.08 1.79 Allowed 'General case' 0 CA--C 1.498 -1.043 0 N-CA-C 115.656 1.725 . . . . 0.0 115.656 -174.743 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.558 ' CG ' ' O ' ' A' ' 27' ' ' GLN . 0.5 OUTLIER 166.54 66.99 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 111.561 -2.563 . . . . 0.0 110.75 179.642 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.797 ' HB2' ' HD1' ' A' ' 79' ' ' HIS . 0.1 OUTLIER -19.1 116.07 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.485 -0.779 . . . . 0.0 112.117 -179.089 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.555 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.275 179.271 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.642 HG23 ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.07 0 CA-C-O 120.852 0.358 . . . . 0.0 110.52 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.587 ' HA ' ' O ' ' A' ' 81' ' ' ALA . . . 4.2 101.5 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.745 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.786 ' N ' ' O ' ' A' ' 81' ' ' ALA . 0.1 OUTLIER -54.4 -33.48 59.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.502 0.668 . . . . 0.0 109.749 178.291 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.48 ' O ' ' N ' ' A' ' 80' ' ' THR . 17.2 m -151.46 125.88 9.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.843 -1.072 . . . . 0.0 109.744 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.898 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.3 OUTLIER -106.33 163.94 12.43 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.278 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.781 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.9 OUTLIER -130.34 27.45 5.05 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 177.243 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.706 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 3.9 ptt-85 -12.39 99.81 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 112.515 -2.13 . . . . 0.0 111.623 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 1.013 HG13 ' HB2' ' A' ' 78' ' ' ASN . 8.2 m -97.61 45.9 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 CA-C-N 114.683 -1.144 . . . . 0.0 109.837 179.174 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.62 ' C ' ' O ' ' A' ' 68' ' ' VAL . 28.8 m -14.65 117.58 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.969 -178.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.775 HG21 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -114.06 -162.43 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 121.768 0.794 . . . . 0.0 111.996 -179.604 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.635 ' O ' ' CD2' ' A' ' 74' ' ' PHE . 9.2 mtm -21.25 143.17 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 113.855 -1.52 . . . . 0.0 112.716 -178.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 43.62 20.86 0.15 Allowed Glycine 0 N--CA 1.444 -0.791 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.768 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.467 ' O ' ' O ' ' A' ' 74' ' ' PHE . . . 81.55 27.94 45.42 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.055 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.635 ' CD2' ' O ' ' A' ' 71' ' ' MET . 38.5 m-85 -50.45 -174.51 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.69 0.281 . . . . 0.0 110.337 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.8 mttt -167.66 104.76 0.51 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.029 0.442 . . . . 0.0 112.057 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.176 HG21 ' CG2' ' A' ' 25' ' ' ILE . 16.8 m -98.13 14.8 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.36 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.392 178.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.898 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.8 OUTLIER 30.77 38.31 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 105.288 -2.115 . . . . 0.0 105.288 -176.869 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 1.013 ' HB2' HG13 ' A' ' 68' ' ' VAL . 30.4 t30 -2.52 66.88 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.974 0 CA-C-N 112.776 -2.011 . . . . 0.0 108.858 -174.352 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.818 ' O ' HD13 ' A' ' 26' ' ' LEU . 36.1 m170 -34.12 120.84 0.45 Allowed 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 113.349 -1.75 . . . . 0.0 112.405 -177.277 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.48 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.9 p -111.3 -14.25 13.82 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.368 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.786 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -165.08 138.86 4.8 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.1 OUTLIER -120.47 145.88 46.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.072 0.463 . . . . 0.0 111.5 -179.142 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.642 ' O ' HG23 ' A' ' 61' ' ' VAL . 3.7 p-80 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.774 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.573 ' O ' ' N ' ' A' ' 29' ' ' MET . 11.7 t . . . . . 0 CA--C 1.518 -0.259 0 CA-C-O 121.246 0.546 . . . . 0.0 111.041 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.169 HD21 ' O ' ' A' ' 79' ' ' HIS . 4.9 mp -64.04 131.28 47.12 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.716 -179.006 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.669 ' O ' ' O ' ' A' ' 14' ' ' GLU . 2.1 mt-30 -114.35 59.1 0.68 Allowed 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.253 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.669 ' O ' ' O ' ' A' ' 13' ' ' GLN . 31.5 tt0 4.56 125.26 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.327 -1.761 . . . . 0.0 112.231 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.763 ' OD1' HG11 ' A' ' 76' ' ' VAL . 0.2 OUTLIER -51.8 123.19 24.04 Favored Pre-proline 0 C--N 1.314 -0.937 0 CA-C-N 114.407 -1.269 . . . . 0.0 111.769 179.978 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.464 ' HD2' ' ND2' ' A' ' 15' ' ' ASN . 84.0 Cg_endo -83.31 20.44 1.17 Allowed 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 122.692 2.261 . . . . 0.0 111.559 179.091 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.615 ' CD1' ' HB ' ' A' ' 70' ' ' VAL . 29.9 t80 -133.2 -52.55 0.9 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.449 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 1.095 ' CD1' HG12 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -77.2 -10.78 59.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.964 -179.647 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.587 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -61.82 83.64 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.002 0.429 . . . . 0.0 110.682 -179.789 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.639 ' HB3' ' HD2' ' A' ' 21' ' ' PRO . 1.1 mt-30 -110.83 164.76 14.1 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.696 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.639 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 27.3 Cg_endo -61.62 61.33 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.574 2.183 . . . . 0.0 111.544 179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 157.41 -15.31 0.32 Allowed Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.469 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.539 ' O ' ' O ' ' A' ' 18' ' ' PHE . . . -148.71 104.86 3.44 Favored Pre-proline 0 CA--C 1.514 -0.415 0 CA-C-O 121.905 0.86 . . . . 0.0 111.654 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.652 ' O ' ' O ' ' A' ' 25' ' ' ILE . 92.3 Cg_endo -105.37 67.39 0.02 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.455 0 C-N-CA 124.756 3.637 . . . . 0.0 113.379 -178.403 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.322 ' CG2' HG21 ' A' ' 76' ' ' VAL . 29.8 mm -41.87 -173.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.032 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.753 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.058 HD11 ' OD1' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -151.51 -157.72 0.84 Allowed 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -175.192 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.529 ' CG ' ' O ' ' A' ' 27' ' ' GLN . 3.8 tt0 169.44 66.12 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 112.895 -1.957 . . . . 0.0 111.321 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.662 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 17.0 t -23.78 99.35 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.7 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.573 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.061 -179.654 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.572 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.877 0.37 . . . . 0.0 111.358 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.795 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 11.67 116.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.345 -0.843 . . . . 0.0 113.096 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.682 ' N ' ' O ' ' A' ' 81' ' ' ALA . 6.0 ttmm -54.53 -38.56 66.7 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 177.775 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.604 ' HB2' ' HB3' ' A' ' 81' ' ' ALA . 2.9 m -134.38 166.38 22.97 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.364 -1.289 . . . . 0.0 108.815 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.756 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 0.5 OUTLIER -151.4 159.28 44.32 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.165 -0.614 . . . . 0.0 112.491 -179.285 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.974 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -128.65 28.07 5.44 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 122.554 1.169 . . . . 0.0 107.903 176.798 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.612 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.5 OUTLIER -4.95 130.67 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 112.174 -2.285 . . . . 0.0 113.09 -179.496 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.943 HG11 ' CD1' ' A' ' 25' ' ' ILE . 1.6 m -144.57 46.79 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.243 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.796 HG23 ' C ' ' A' ' 73' ' ' GLY . 16.9 m -12.05 122.33 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.75 -1.113 . . . . 0.0 111.649 -179.772 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 1.095 HG12 ' CD1' ' A' ' 18' ' ' PHE . 3.7 m -119.03 -169.1 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.946 0.879 . . . . 0.0 112.759 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.758 ' HG2' HG23 ' A' ' 70' ' ' VAL . 0.4 OUTLIER 21.34 -120.57 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.02 -1.445 . . . . 0.0 112.529 179.917 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.405 ' H ' ' CG ' ' A' ' 71' ' ' MET . . . -70.75 31.66 0.49 Allowed Glycine 0 CA--C 1.518 0.231 0 CA-C-N 115.986 -0.552 . . . . 0.0 113.504 -178.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.796 ' C ' HG23 ' A' ' 69' ' ' THR . . . 90.85 22.1 34.34 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.685 -0.769 . . . . 0.0 111.756 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.786 ' HB2' HG22 ' A' ' 70' ' ' VAL . 0.6 OUTLIER -45.7 -178.95 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.091 0.472 . . . . 0.0 111.374 -179.887 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.558 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -154.66 82.33 1.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.369 179.543 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.322 HG21 ' CG2' ' A' ' 25' ' ' ILE . 27.2 m -78.38 12.25 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.493 -1.241 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.229 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.838 ' CG ' ' HE2' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 24.07 44.58 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 -178.364 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 1.058 ' OD1' HD11 ' A' ' 26' ' ' LEU . 31.3 t-20 6.36 63.36 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 -174.367 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 1.169 ' O ' HD21 ' A' ' 12' ' ' LEU . 32.2 m170 -37.98 108.79 0.09 Allowed 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.433 -176.455 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.559 HG23 ' O ' ' A' ' 78' ' ' ASN . 4.7 p -104.48 -5.14 21.89 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.012 -1.449 . . . . 0.0 110.702 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.682 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -162.06 144.32 11.33 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 179.082 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.591 ' SG ' ' CD1' ' A' ' 12' ' ' LEU . 84.5 m -121.13 157.56 29.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.062 0.458 . . . . 0.0 111.718 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.474 ' HB3' ' O ' ' A' ' 82' ' ' CYS . 2.0 p-80 . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.377 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.846 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.512 -0.497 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.168 HD21 ' O ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER -111.5 129.53 56.02 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.156 179.226 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.629 ' HG3' ' HB2' ' A' ' 29' ' ' MET . 0.1 OUTLIER -103.01 48.15 0.86 Allowed 'General case' 0 CA--C 1.502 -0.899 0 CA-C-O 121.713 0.768 . . . . 0.0 110.846 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.611 ' C ' ' O ' ' A' ' 13' ' ' GLN . 39.4 tt0 -7.12 120.69 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.52 -1.673 . . . . 0.0 110.619 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.727 ' CB ' ' HB ' ' A' ' 25' ' ' ILE . 0.4 OUTLIER -54.46 98.95 0.19 Allowed Pre-proline 0 C--N 1.306 -1.318 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.98 -178.904 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.572 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 2.8 Cg_exo -73.84 6.0 3.12 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.464 2.109 . . . . 0.0 109.224 177.809 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.488 ' H ' ' C ' ' A' ' 15' ' ' ASN . 1.0 OUTLIER -101.27 -54.3 2.81 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 113.671 -1.604 . . . . 0.0 110.398 -179.673 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.885 ' CD2' HG21 ' A' ' 70' ' ' VAL . 0.4 OUTLIER -86.97 -21.77 25.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.879 -179.714 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.724 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 28.2 t -37.9 107.53 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.758 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.812 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -115.0 171.29 4.59 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.945 -179.692 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -65.63 70.29 0.34 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.855 2.37 . . . . 0.0 111.601 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 135.29 -5.79 4.24 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.197 -179.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.812 ' HB3' ' HG3' ' A' ' 20' ' ' GLN . . . -151.37 102.72 2.93 Favored Pre-proline 0 CA--C 1.513 -0.459 0 CA-C-O 122.037 0.922 . . . . 0.0 111.526 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.724 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 88.6 Cg_endo -103.0 80.02 0.03 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.529 0 C-N-CA 124.788 3.659 . . . . 0.0 113.131 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.224 ' CG2' HG21 ' A' ' 76' ' ' VAL . 15.1 mm -40.8 -177.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.97 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.634 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.08 HD13 HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -152.04 -160.82 1.2 Allowed 'General case' 0 CA--C 1.498 -1.057 0 CA-C-O 122.681 1.229 . . . . 0.0 114.237 -175.624 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.527 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 4.7 tt0 159.98 62.21 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 112.348 -2.206 . . . . 0.0 110.324 179.776 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.753 ' SG ' ' HB3' ' A' ' 79' ' ' HIS . 75.9 m -23.35 118.69 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.275 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.629 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.387 0 CA-C-O 121.003 0.43 . . . . 0.0 111.389 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.515 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.1 OUTLIER . . . . . 0 CA--C 1.522 -0.107 0 CA-C-O 121.154 0.502 . . . . 0.0 111.288 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.771 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 44.15 112.85 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.528 179.2 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.673 ' HB3' ' CB ' ' A' ' 81' ' ' ALA . 19.5 ttmt -56.12 -36.69 68.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.589 0.709 . . . . 0.0 109.243 178.053 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.552 ' O ' ' N ' ' A' ' 80' ' ' THR . 18.5 m -147.09 135.17 21.5 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.752 -1.113 . . . . 0.0 108.62 179.249 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.726 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.3 OUTLIER -119.29 155.27 32.11 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.235 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.95 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -128.91 26.71 5.51 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 176.289 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.692 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.5 OUTLIER -4.91 127.62 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 112.58 -2.1 . . . . 0.0 111.769 -179.529 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.98 HG21 ' CD1' ' A' ' 25' ' ' ILE . 2.4 m -128.09 42.43 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.837 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.673 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 73.4 m -19.04 118.2 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.598 -179.032 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.885 HG21 ' CD2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -129.87 -167.5 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.732 179.741 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.611 ' HG3' ' CD2' ' A' ' 74' ' ' PHE . 0.2 OUTLIER 37.04 -137.94 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.342 -179.701 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -80.35 30.63 2.44 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.308 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.66 47.09 0.99 Allowed Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.336 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.673 ' O ' ' HA ' ' A' ' 69' ' ' THR . 9.2 m-30 -90.47 113.42 25.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.844 0.354 . . . . 0.0 110.904 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.597 ' HB3' ' OE1' ' A' ' 77' ' ' GLU . 1.9 mmmm -99.44 107.61 19.87 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.129 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.224 HG21 ' CG2' ' A' ' 25' ' ' ILE . 11.8 m -97.24 15.84 2.98 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.499 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.43 178.648 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.726 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 25.03 41.97 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.132 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -177.344 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.991 ' C ' HD12 ' A' ' 26' ' ' LEU . 10.9 t-20 9.19 65.58 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.998 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 -175.725 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 1.168 ' O ' HD21 ' A' ' 12' ' ' LEU . 25.6 m170 -42.27 89.73 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 122.455 1.122 . . . . 0.0 111.977 -175.816 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.716 HG22 ' OD1' ' A' ' 78' ' ' ASN . 4.2 p -79.88 -1.33 38.68 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 113.712 -1.585 . . . . 0.0 110.408 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.673 ' CB ' ' HB3' ' A' ' 63' ' ' LYS . . . -177.17 147.05 0.53 Allowed 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.203 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.826 ' SG ' HD12 ' A' ' 12' ' ' LEU . 2.7 m -116.15 164.94 13.74 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.875 0.369 . . . . 0.0 111.178 -179.279 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.48 ' CG ' ' O ' ' A' ' 83' ' ' HIS . 6.5 p-80 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.941 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.557 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 2.7 t . . . . . 0 CA--C 1.517 -0.301 0 CA-C-O 120.953 0.406 . . . . 0.0 110.611 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.999 HD23 HD13 ' A' ' 26' ' ' LEU . 6.5 mp -90.12 136.9 32.77 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.042 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.609 ' O ' ' O ' ' A' ' 14' ' ' GLU . 4.9 mt-30 -108.98 55.11 0.64 Allowed 'General case' 0 CA--C 1.503 -0.863 0 CA-C-O 121.739 0.781 . . . . 0.0 110.55 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.609 ' O ' ' O ' ' A' ' 13' ' ' GLN . 26.8 tt0 -1.13 122.12 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 113.419 -1.719 . . . . 0.0 111.203 -179.271 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.752 ' HB2' HG22 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -50.49 98.5 0.18 Allowed Pre-proline 0 C--N 1.304 -1.371 0 CA-C-N 114.154 -1.385 . . . . 0.0 111.904 -179.201 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.52 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 7.0 Cg_exo -71.8 20.45 0.27 Allowed 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 122.373 2.049 . . . . 0.0 109.592 177.74 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.628 ' H ' ' C ' ' A' ' 15' ' ' ASN . 1.5 t80 -125.1 -55.8 1.57 Allowed 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.157 -178.76 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.729 ' CD2' HG21 ' A' ' 70' ' ' VAL . 2.0 m-30 -83.12 -6.17 59.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.173 -179.531 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.707 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 6.1 t -60.45 83.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.769 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.79 ' O ' ' N ' ' A' ' 22' ' ' GLY . 9.0 mm100 -97.66 145.03 29.01 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.802 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -44.12 69.96 0.01 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.736 2.29 . . . . 0.0 111.459 179.696 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.79 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 153.06 -20.2 0.75 Allowed Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.126 -179.19 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.486 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -150.44 108.64 3.15 Favored Pre-proline 0 CA--C 1.515 -0.382 0 CA-C-O 121.892 0.853 . . . . 0.0 111.519 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.707 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 62.9 Cg_endo -101.74 73.06 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.35 0 C-N-CA 124.705 3.603 . . . . 0.0 113.22 -178.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.161 ' CG2' HG21 ' A' ' 76' ' ' VAL . 6.9 mm -40.63 -176.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 N-CA-C 113.483 0.919 . . . . 0.0 113.483 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.073 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER -150.21 -162.48 1.56 Allowed 'General case' 0 CA--C 1.502 -0.888 0 CA-C-O 122.635 1.207 . . . . 0.0 114.175 -175.692 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.531 ' O ' ' C ' ' A' ' 28' ' ' CYS . 10.6 tt0 164.2 77.67 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 112.661 -2.063 . . . . 0.0 110.903 179.493 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.622 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER -19.21 114.65 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.28 -179.568 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.544 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.8 mtp . . . . . 0 C--N 1.33 -0.269 0 CA-C-O 120.799 0.333 . . . . 0.0 111.204 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.561 ' O ' ' C ' ' A' ' 62' ' ' ALA . 6.0 t . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.702 0.286 . . . . 0.0 110.66 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.581 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 7.65 111.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.589 -179.747 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.762 ' N ' ' O ' ' A' ' 81' ' ' ALA . 6.2 tptp -55.2 -39.23 69.39 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.73 0.776 . . . . 0.0 109.377 178.436 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.515 ' HB3' ' OG1' ' A' ' 80' ' ' THR . 0.7 OUTLIER -147.41 133.12 18.89 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.353 179.56 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.669 ' HB2' ' C ' ' A' ' 77' ' ' GLU . 1.6 p90 -115.91 169.54 9.16 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 121.879 0.847 . . . . 0.0 112.527 -178.506 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.772 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -131.45 27.5 4.72 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 113.888 -1.506 . . . . 0.0 107.133 176.104 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.549 ' HA ' ' CA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -4.99 92.6 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.15 -2.296 . . . . 0.0 111.319 -179.736 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.932 HG11 HD11 ' A' ' 25' ' ' ILE . 30.1 t -94.14 71.68 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.401 0 CA-C-N 113.213 -1.812 . . . . 0.0 111.089 -179.27 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.68 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 99.6 m -54.09 117.72 3.46 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.174 0.511 . . . . 0.0 110.441 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.729 HG21 ' CD2' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -128.13 -166.64 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.849 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.683 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 1.5 mmm 35.89 -135.42 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.53 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -82.16 30.33 3.01 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.357 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 106.33 53.9 0.72 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.545 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.683 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 4.0 m-85 -100.42 112.88 25.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.747 0.308 . . . . 0.0 111.047 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.482 ' O ' ' OE2' ' A' ' 77' ' ' GLU . 19.0 mtpt -99.94 108.98 21.35 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.287 0.565 . . . . 0.0 111.433 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.161 HG21 ' CG2' ' A' ' 25' ' ' ILE . 15.8 m -94.76 18.0 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.486 -1.483 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.667 179.163 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.84 ' O ' ' HD2' ' A' ' 79' ' ' HIS . 0.4 OUTLIER 29.77 39.12 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 -176.099 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.924 ' HB2' HG23 ' A' ' 68' ' ' VAL . 38.3 t30 -8.02 70.08 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 113.332 -1.758 . . . . 0.0 108.582 -174.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 1.073 ' N ' HD12 ' A' ' 26' ' ' LEU . 42.5 m170 -40.5 118.04 0.89 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 112.958 -1.928 . . . . 0.0 114.246 -176.154 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.515 ' OG1' ' HB3' ' A' ' 64' ' ' SER . 2.3 p -103.46 -7.78 20.66 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 113.481 -1.69 . . . . 0.0 109.888 178.541 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.762 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -174.38 140.46 0.65 Allowed 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.543 179.177 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.642 ' SG ' HD11 ' A' ' 12' ' ' LEU . 1.3 m -128.54 121.56 29.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.714 0.292 . . . . 0.0 110.268 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.425 ' CG ' ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 121.088 0.47 . . . . 0.0 111.677 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.766 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 2.9 t . . . . . 0 CA--C 1.518 -0.277 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.044 HD23 HD13 ' A' ' 26' ' ' LEU . 4.2 mp -100.86 138.87 37.34 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.085 0.469 . . . . 0.0 111.189 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.653 ' CG ' ' HB2' ' A' ' 29' ' ' MET . 2.4 mt-30 -108.92 58.67 0.6 Allowed 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.209 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.641 ' HG3' ' O ' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -4.12 122.28 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 114.03 -1.441 . . . . 0.0 111.469 -179.429 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.761 ' OD1' HG11 ' A' ' 76' ' ' VAL . 0.2 OUTLIER -54.92 117.93 15.66 Favored Pre-proline 0 C--N 1.311 -1.105 0 CA-C-N 114.689 -1.141 . . . . 0.0 111.939 -179.569 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.599 ' HD2' HD21 ' A' ' 15' ' ' ASN . 97.7 Cg_endo -81.16 14.62 2.06 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.682 2.254 . . . . 0.0 111.556 179.009 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.471 ' CD2' ' SD ' ' A' ' 71' ' ' MET . 22.9 t80 -119.46 -55.74 2.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.146 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.841 ' CD2' HG13 ' A' ' 70' ' ' VAL . 0.7 OUTLIER -72.83 -10.67 60.06 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.152 -179.712 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.63 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 11.0 p -58.2 98.31 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.409 -179.55 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.639 ' O ' ' N ' ' A' ' 22' ' ' GLY . 26.2 mt-30 -121.96 152.76 60.14 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.905 178.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -45.28 75.79 0.01 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.178 0 C-N-CA 122.734 2.29 . . . . 0.0 112.638 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.639 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 127.86 2.76 6.09 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.556 -0.831 . . . . 0.0 113.269 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.435 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -160.19 98.17 1.46 Allowed Pre-proline 0 CA--C 1.514 -0.432 0 CA-C-O 122.084 0.945 . . . . 0.0 111.769 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.63 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 98.6 Cg_endo -107.73 81.7 0.02 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.575 0 C-N-CA 125.235 3.956 . . . . 0.0 113.5 -178.259 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.295 ' CG2' HG21 ' A' ' 76' ' ' VAL . 23.0 mm -44.75 -177.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.048 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -147.56 -158.79 0.95 Allowed 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 -175.386 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.519 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 6.9 tm0? 161.85 94.85 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 112.431 -2.168 . . . . 0.0 109.601 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.916 ' H ' ' CD2' ' A' ' 79' ' ' HIS . 0.5 OUTLIER -36.01 110.71 0.11 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.9 -178.292 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.658 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.1 tpt . . . . . 0 C--N 1.331 -0.221 0 CA-C-O 120.938 0.399 . . . . 0.0 110.068 178.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.657 HG23 ' O ' ' A' ' 61' ' ' VAL . 30.9 m . . . . . 0 CA--C 1.518 -0.264 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.715 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 18.08 103.89 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.656 -178.386 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.973 ' N ' ' O ' ' A' ' 81' ' ' ALA . 6.5 tppt? -52.84 -31.82 41.22 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 121.971 0.891 . . . . 0.0 108.858 178.542 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.593 ' HB3' ' OG1' ' A' ' 80' ' ' THR . 3.7 t -144.21 152.05 40.33 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 113.806 -1.543 . . . . 0.0 108.535 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.656 ' CG ' ' CG ' ' A' ' 77' ' ' GLU . 1.8 p90 -135.69 164.83 26.98 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.575 0.702 . . . . 0.0 112.093 -179.272 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.674 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 6.6 t-20 -134.66 26.36 3.7 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 122.76 1.267 . . . . 0.0 108.42 177.601 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.696 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -9.95 132.09 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 112.007 -2.36 . . . . 0.0 112.371 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.979 HG21 HG13 ' A' ' 25' ' ' ILE . 2.2 m -140.02 44.19 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.873 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.683 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 45.5 m -10.3 119.1 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.888 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.841 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -116.58 -168.68 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.577 0.704 . . . . 0.0 112.082 179.748 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.66 ' HG3' ' CG ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER 27.96 -139.33 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.581 -1.19 . . . . 0.0 110.954 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -69.5 10.21 2.14 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.614 179.576 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.463 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 129.26 55.58 0.1 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.986 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.683 ' O ' ' HA ' ' A' ' 69' ' ' THR . 2.0 m-85 -95.33 108.57 20.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.988 0.423 . . . . 0.0 111.051 -179.614 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.479 ' HG2' ' OG1' ' A' ' 69' ' ' THR . 5.3 mtpt -96.44 100.26 11.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.369 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.295 HG21 ' CG2' ' A' ' 25' ' ' ILE . 22.6 m -87.38 11.8 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.339 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.307 179.515 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.748 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 30.68 39.11 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 -177.094 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.726 ' HB2' HG13 ' A' ' 68' ' ' VAL . 52.3 t30 -3.68 67.45 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 112.98 -1.918 . . . . 0.0 109.092 -174.943 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 1.048 ' N ' HD12 ' A' ' 26' ' ' LEU . 2.2 m-70 -37.18 119.45 0.68 Allowed 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 112.802 -1.999 . . . . 0.0 114.362 -176.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.593 ' OG1' ' HB3' ' A' ' 64' ' ' SER . 0.7 OUTLIER -108.95 -7.37 15.42 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 113.552 -1.658 . . . . 0.0 109.926 178.136 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.973 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -168.91 122.08 0.81 Allowed 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.98 178.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.488 ' SG ' HD11 ' A' ' 12' ' ' LEU . 1.3 m -119.11 120.09 36.12 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.653 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.786 ' ND1' ' HB2' ' A' ' 63' ' ' LYS . 0.6 OUTLIER . . . . . 0 N--CA 1.466 0.325 0 CA-C-O 121.1 0.476 . . . . 0.0 112.237 -178.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.489 ' O ' ' N ' ' A' ' 29' ' ' MET . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.27 0 CA-C-O 120.893 0.378 . . . . 0.0 110.92 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.087 ' CD2' HD13 ' A' ' 26' ' ' LEU . 1.4 mp -60.35 124.25 19.76 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.062 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.654 ' HG3' ' CB ' ' A' ' 29' ' ' MET . 0.7 OUTLIER -116.67 60.52 0.74 Allowed 'General case' 0 CA--C 1.502 -0.867 0 CA-C-O 122.044 0.925 . . . . 0.0 111.723 -179.257 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.684 ' CD ' ' HB2' ' A' ' 24' ' ' PRO . 33.3 tt0 3.92 120.42 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 112.949 -1.932 . . . . 0.0 111.459 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.75 ' ND2' HG11 ' A' ' 76' ' ' VAL . 0.5 OUTLIER -53.89 100.74 0.23 Allowed Pre-proline 0 C--N 1.307 -1.264 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.562 -179.608 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.616 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 56.8 Cg_endo -69.98 5.4 1.8 Allowed 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 121.702 1.602 . . . . 0.0 109.951 178.054 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.597 ' CZ ' ' SD ' ' A' ' 71' ' ' MET . 0.3 OUTLIER -101.47 -60.64 1.49 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 113.992 -1.458 . . . . 0.0 110.847 -179.779 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.914 ' CD2' HG21 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -82.67 -2.17 53.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.651 -179.576 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.629 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -59.27 83.77 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.598 179.647 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.56 ' O ' ' N ' ' A' ' 22' ' ' GLY . 4.2 mt-30 -92.94 164.88 20.09 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.407 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.16 59.22 0.17 Allowed 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 122.527 2.151 . . . . 0.0 111.174 179.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.56 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 154.7 -14.93 0.53 Allowed Glycine 0 N--CA 1.449 -0.461 0 CA-C-N 115.716 -0.674 . . . . 0.0 112.549 -179.379 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.437 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -142.52 105.16 5.45 Favored Pre-proline 0 CA--C 1.513 -0.448 0 CA-C-O 121.916 0.865 . . . . 0.0 111.374 -179.588 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.684 ' HB2' ' CD ' ' A' ' 14' ' ' GLU . 71.9 Cg_endo -104.05 75.93 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.391 0 C-N-CA 124.687 3.592 . . . . 0.0 114.358 -177.871 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.275 ' CG2' HG21 ' A' ' 76' ' ' VAL . 15.2 mm -44.17 -175.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 178.85 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.087 HD13 ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -148.65 -161.19 1.29 Allowed 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -176.879 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.652 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 20.8 tt0 161.79 82.91 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 112.421 -2.172 . . . . 0.0 110.822 179.545 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 1.3 m -35.06 101.83 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.774 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.654 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.372 0 CA-C-O 120.889 0.376 . . . . 0.0 111.225 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.598 ' O ' HG13 ' A' ' 61' ' ' VAL . 7.1 p . . . . . 0 N--CA 1.457 -0.098 0 CA-C-O 120.75 0.309 . . . . 0.0 110.739 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.587 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 9.11 107.31 0.0 OUTLIER 'General case' 0 C--O 1.231 0.103 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.164 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.882 ' N ' ' O ' ' A' ' 81' ' ' ALA . 2.4 ttmm -55.35 -39.3 69.89 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.652 0.739 . . . . 0.0 109.372 178.625 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.513 ' N ' ' HB3' ' A' ' 81' ' ' ALA . 2.4 m -144.13 135.03 25.23 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.108 179.362 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.868 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.2 OUTLIER -119.45 160.59 22.06 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.128 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.936 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -123.6 27.65 7.29 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-O 122.5 1.143 . . . . 0.0 107.938 177.423 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.539 ' O ' ' O ' ' A' ' 66' ' ' ASN . 1.9 ttm180 -6.33 128.67 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 112.311 -2.222 . . . . 0.0 112.237 -179.647 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.979 HG21 ' CD1' ' A' ' 25' ' ' ILE . 1.5 m -134.64 36.04 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.954 179.667 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.594 ' C ' ' O ' ' A' ' 68' ' ' VAL . 23.4 m -17.34 120.55 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.471 -179.688 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.914 HG21 ' CD2' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -125.92 -168.01 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-O 121.718 0.771 . . . . 0.0 112.447 -178.457 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.601 ' H ' HG12 ' A' ' 70' ' ' VAL . 0.5 OUTLIER 43.86 -134.49 0.57 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.411 -1.268 . . . . 0.0 111.062 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.439 ' H ' ' HB3' ' A' ' 71' ' ' MET . . . -84.94 23.02 8.25 Favored Glycine 0 N--CA 1.434 -1.45 0 C-N-CA 120.71 -0.757 . . . . 0.0 111.694 179.473 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 118.03 37.09 0.9 Allowed Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.183 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.586 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 3.3 m-85 -68.64 -177.66 1.0 Allowed 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 1.5 mtmp? -159.53 134.37 7.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.273 0.559 . . . . 0.0 111.972 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.275 HG21 ' CG2' ' A' ' 25' ' ' ILE . 18.8 m -140.07 15.22 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.492 -1.255 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.476 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.868 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 20.42 46.58 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -178.069 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.989 ' OD1' HD11 ' A' ' 26' ' ' LEU . 27.4 t-20 1.18 70.78 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 114.262 -1.335 . . . . 0.0 108.215 -174.73 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 1.02 ' O ' HD21 ' A' ' 12' ' ' LEU . 33.6 m170 -39.36 111.42 0.18 Allowed 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 122.582 1.182 . . . . 0.0 111.957 -176.502 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.664 HG23 ' O ' ' A' ' 78' ' ' ASN . 8.9 p -108.16 -9.33 15.58 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.601 -1.636 . . . . 0.0 110.101 -179.375 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.882 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -165.42 128.55 2.19 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 178.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.1 OUTLIER -117.67 143.39 46.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.668 0.271 . . . . 0.0 110.753 -178.935 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.448 ' NE2' ' HA ' ' A' ' 63' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.332 -0.193 0 CA-C-O 120.867 0.365 . . . . 0.0 111.516 -179.473 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.593 ' O ' ' N ' ' A' ' 29' ' ' MET . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.243 0 CA-C-O 120.847 0.356 . . . . 0.0 111.388 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.102 HD21 ' O ' ' A' ' 79' ' ' HIS . 3.5 mp -51.2 123.07 8.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.243 179.509 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.704 ' O ' ' O ' ' A' ' 14' ' ' GLU . 2.0 mm-40 -123.34 61.45 1.05 Allowed 'General case' 0 CA--C 1.502 -0.895 0 CA-C-O 122.251 1.024 . . . . 0.0 110.933 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.704 ' O ' ' O ' ' A' ' 13' ' ' GLN . 16.6 tt0 8.29 126.92 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 112.484 -2.144 . . . . 0.0 112.313 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.732 ' OD1' HG11 ' A' ' 76' ' ' VAL . 0.1 OUTLIER -49.86 128.96 21.11 Favored Pre-proline 0 C--N 1.311 -1.096 0 CA-C-N 114.232 -1.349 . . . . 0.0 111.253 179.694 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.441 ' HD2' HD21 ' A' ' 15' ' ' ASN . 93.8 Cg_endo -86.06 27.87 0.57 Allowed 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.598 2.198 . . . . 0.0 111.517 179.239 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.565 ' HB2' ' HE1' ' A' ' 71' ' ' MET . 54.2 t80 -143.29 -52.65 0.36 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.924 -179.553 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.966 ' CE2' HG23 ' A' ' 68' ' ' VAL . 0.2 OUTLIER -74.86 -15.43 60.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.28 -179.163 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.92 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -55.5 92.54 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.315 -179.547 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.541 ' O ' ' N ' ' A' ' 22' ' ' GLY . 7.3 mm-40 -121.07 166.51 15.66 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-O 120.916 0.388 . . . . 0.0 111.147 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.5 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 31.2 Cg_exo -59.28 64.46 0.06 OUTLIER 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.992 2.461 . . . . 0.0 112.194 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.541 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 144.94 -9.89 1.81 Allowed Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.35 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.499 ' O ' ' O ' ' A' ' 18' ' ' PHE . . . -153.19 99.13 2.71 Favored Pre-proline 0 CA--C 1.51 -0.583 0 CA-C-O 122.02 0.914 . . . . 0.0 111.798 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.92 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 71.7 Cg_endo -107.64 72.71 0.02 OUTLIER 'Trans proline' 0 N--CA 1.436 -1.878 0 C-N-CA 124.965 3.777 . . . . 0.0 113.251 -178.431 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.237 ' CG2' HG21 ' A' ' 76' ' ' VAL . 22.7 mm -40.09 -176.89 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.043 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.158 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.018 HD11 ' OD1' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -148.58 -159.58 1.05 Allowed 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 122.484 1.135 . . . . 0.0 113.826 -176.356 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.539 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 1.2 tp-100 160.01 75.29 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 112.921 -1.945 . . . . 0.0 110.802 179.646 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 2.3 m -22.74 111.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.618 -179.553 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.593 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.8 OUTLIER . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.638 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.745 ' O ' HG13 ' A' ' 61' ' ' VAL . 4.3 p . . . . . 0 CA--C 1.511 -0.528 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.763 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 37.29 113.78 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.527 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.74 ' N ' ' O ' ' A' ' 81' ' ' ALA . 4.3 ttmm -52.33 -39.66 60.93 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.674 0.75 . . . . 0.0 109.014 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.529 ' HB3' ' OG1' ' A' ' 80' ' ' THR . 4.4 m -141.13 139.78 34.01 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.971 178.825 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.684 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 7.2 p90 -123.51 159.38 29.24 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.181 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.928 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -126.71 26.07 6.3 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 122.825 1.298 . . . . 0.0 107.826 176.87 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.522 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -3.0 129.75 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 111.912 -2.404 . . . . 0.0 113.766 -179.273 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.966 HG23 ' CE2' ' A' ' 18' ' ' PHE . 1.9 m -149.26 87.7 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.962 178.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.663 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 98.7 m -57.5 127.0 29.82 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.6 0.714 . . . . 0.0 111.955 -178.04 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.831 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -126.27 -170.23 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 114.684 -1.144 . . . . 0.0 111.124 179.383 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.565 ' HE1' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER 30.55 -136.55 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.058 179.592 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -73.23 21.57 1.06 Allowed Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.695 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.642 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 115.54 33.75 1.54 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.555 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.663 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.2 m-85 -69.0 110.46 4.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.106 0.479 . . . . 0.0 111.233 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.81 89.63 5.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.807 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.237 HG21 ' CG2' ' A' ' 25' ' ' ILE . 25.5 m -78.76 13.89 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.495 -1.155 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.904 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.7 ' O ' ' C ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER 23.76 44.74 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 105.685 -1.969 . . . . 0.0 105.685 -177.698 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 1.018 ' OD1' HD11 ' A' ' 26' ' ' LEU . 26.6 t-20 1.48 71.96 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.096 0 CA-C-N 114.196 -1.365 . . . . 0.0 108.371 -174.22 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 1.102 ' O ' HD21 ' A' ' 12' ' ' LEU . 36.4 m170 -41.85 111.6 0.25 Allowed 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 122.644 1.211 . . . . 0.0 111.93 -176.73 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.582 HG23 ' O ' ' A' ' 78' ' ' ASN . 7.6 p -104.53 -3.32 24.05 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 113.6 -1.637 . . . . 0.0 109.628 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.74 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -171.96 138.6 1.05 Allowed 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.2 OUTLIER -120.86 157.24 30.23 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.729 -0.389 . . . . 0.0 111.325 -179.031 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.43 ' CE1' ' HA ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.343 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.903 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.517 -0.313 0 CA-C-O 120.634 0.254 . . . . 0.0 110.326 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.119 HD21 ' O ' ' A' ' 79' ' ' HIS . 0.5 OUTLIER -114.38 129.71 56.66 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.668 179.83 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.668 ' HG3' ' CB ' ' A' ' 29' ' ' MET . 1.8 mm-40 -97.84 44.83 1.03 Allowed 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 121.7 0.762 . . . . 0.0 110.81 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.797 ' HG3' HD23 ' A' ' 26' ' ' LEU . 5.9 tt0 -5.22 122.8 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 113.617 -1.629 . . . . 0.0 110.945 -179.377 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.852 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.6 OUTLIER -69.38 105.07 0.91 Allowed Pre-proline 0 C--N 1.309 -1.156 0 CA-C-N 114.691 -1.14 . . . . 0.0 113.095 -178.343 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.516 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 3.7 Cg_exo -78.33 3.81 6.82 Favored 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 122.819 2.346 . . . . 0.0 109.472 177.328 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.507 ' HB3' ' OD1' ' A' ' 15' ' ' ASN . 1.3 t80 -94.61 -63.35 1.19 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 113.874 -1.512 . . . . 0.0 110.08 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 1.059 ' CG ' HG21 ' A' ' 70' ' ' VAL . 8.4 m-85 -79.7 -0.39 33.89 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.362 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.769 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -53.94 104.18 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.942 -179.793 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.712 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 0.3 OUTLIER -106.43 177.17 1.41 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.833 179.85 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.525 ' HD2' ' HB2' ' A' ' 20' ' ' GLN . 35.1 Cg_exo -59.55 68.23 0.06 OUTLIER 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.676 2.251 . . . . 0.0 112.018 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.528 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 124.65 19.51 2.51 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.395 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.712 ' HB3' ' HG3' ' A' ' 20' ' ' GLN . . . -167.0 100.77 0.64 Allowed Pre-proline 0 CA--C 1.509 -0.61 0 CA-C-O 121.952 0.882 . . . . 0.0 110.971 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.793 ' O ' ' O ' ' A' ' 25' ' ' ILE . 28.1 Cg_endo -94.35 23.85 0.42 Allowed 'Trans proline' 0 N--CA 1.452 -0.968 0 C-N-CA 124.525 3.484 . . . . 0.0 113.049 -178.861 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.143 ' CG2' HG21 ' A' ' 76' ' ' VAL . 9.8 mm 25.38 -174.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 114.684 -1.144 . . . . 0.0 113.046 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.091 HD13 ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -159.75 -160.61 0.83 Allowed 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -174.723 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.595 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 2.6 tp60 161.27 59.5 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 112.176 -2.284 . . . . 0.0 110.477 179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.687 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 73.6 m -15.87 121.29 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.266 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.668 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.757 179.063 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.849 ' O ' HG12 ' A' ' 61' ' ' VAL . 25.3 t . . . . . 0 C--O 1.23 0.071 0 CA-C-O 121.15 0.5 . . . . 0.0 110.354 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.819 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 26.18 92.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.431 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.86 ' N ' ' O ' ' A' ' 81' ' ' ALA . 8.6 tptp -47.04 -33.84 5.19 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 177.496 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.746 ' O ' ' HB1' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -139.34 -175.61 4.24 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 113.833 -1.531 . . . . 0.0 108.646 178.982 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.907 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -158.88 162.98 37.0 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.554 0.692 . . . . 0.0 112.246 -179.466 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.789 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.2 OUTLIER -133.84 27.53 3.94 Favored 'General case' 0 CA--C 1.504 -0.817 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 176.777 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.631 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -8.66 129.9 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 112.205 -2.27 . . . . 0.0 111.935 -179.607 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 1.029 HG21 ' CD1' ' A' ' 25' ' ' ILE . 4.3 m -134.04 46.85 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.759 179.589 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.565 ' C ' ' O ' ' A' ' 68' ' ' VAL . 41.1 m -20.09 118.56 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.993 -178.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 1.059 HG21 ' CG ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -123.41 -170.0 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.109 -179.048 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.639 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 80.7 mtp 38.99 -134.23 0.14 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.635 179.57 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -75.87 12.33 8.99 Favored Glycine 0 N--CA 1.441 -0.992 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.976 -179.547 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 122.1 37.67 0.64 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.236 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.639 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 7.1 m-85 -67.14 -176.27 0.53 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.94 92.85 0.87 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.722 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.143 HG21 ' CG2' ' A' ' 25' ' ' ILE . 29.8 m -86.24 10.6 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.342 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.619 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.907 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.5 OUTLIER 30.53 39.38 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 -176.986 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.974 ' HB2' HG13 ' A' ' 68' ' ' VAL . 48.7 t30 1.75 64.69 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 113.081 -1.872 . . . . 0.0 108.26 -174.391 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 1.119 ' O ' HD21 ' A' ' 12' ' ' LEU . 32.8 m170 -31.73 121.49 0.27 Allowed 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 112.764 -2.017 . . . . 0.0 113.28 -176.909 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.565 ' OG1' ' HB2' ' A' ' 64' ' ' SER . 6.9 p -111.08 -13.64 14.02 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 113.999 -1.455 . . . . 0.0 110.568 -179.812 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.86 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -164.18 135.26 4.42 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.458 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.944 ' SG ' HD12 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -114.03 127.1 55.79 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.474 -0.49 . . . . 0.0 112.23 -178.765 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.494 ' CG ' ' O ' ' A' ' 83' ' ' HIS . 8.4 p-80 . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.934 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.644 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 0.3 OUTLIER . . . . . 0 CA--C 1.508 -0.648 0 CA-C-O 121.339 0.59 . . . . 0.0 111.973 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.242 HD21 ' O ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER -67.59 113.33 5.32 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.997 -1.002 . . . . 0.0 109.602 178.205 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.605 ' HG3' ' HB2' ' A' ' 29' ' ' MET . 1.3 mm-40 -101.77 52.75 0.82 Allowed 'General case' 0 CA--C 1.499 -0.997 0 CA-C-O 122.119 0.962 . . . . 0.0 110.527 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.595 ' C ' ' O ' ' A' ' 13' ' ' GLN . 4.7 tt0 -4.47 118.0 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 112.761 -2.018 . . . . 0.0 110.845 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.697 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.4 OUTLIER -54.63 102.54 0.31 Allowed Pre-proline 0 C--N 1.302 -1.489 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.382 -178.787 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.454 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 1.4 Cg_endo -76.65 1.33 8.62 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.223 1.949 . . . . 0.0 109.046 177.349 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.736 ' CE1' ' HE1' ' A' ' 71' ' ' MET . 1.1 t80 -93.51 -53.64 3.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 113.518 -1.674 . . . . 0.0 110.08 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.88 ' CE2' HG21 ' A' ' 70' ' ' VAL . 4.0 m-85 -87.5 -4.98 58.99 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.63 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.646 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.7 OUTLIER -48.46 97.36 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.346 179.402 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.62 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -101.23 158.28 32.09 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.667 -179.511 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.438 ' CD ' ' HG3' ' A' ' 20' ' ' GLN . 32.5 Cg_exo -57.98 65.76 0.05 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.582 2.188 . . . . 0.0 111.044 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.62 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 134.66 1.06 3.49 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.168 -179.134 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -150.82 99.99 3.1 Favored Pre-proline 0 CA--C 1.512 -0.519 0 CA-C-O 122.022 0.915 . . . . 0.0 111.424 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.646 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 93.2 Cg_endo -103.23 78.87 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.414 0 C-N-CA 124.809 3.673 . . . . 0.0 113.318 -178.492 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.182 ' CG2' HG21 ' A' ' 76' ' ' VAL . 15.3 mm -40.45 -177.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.014 HD13 HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -150.75 -162.76 1.62 Allowed 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 122.413 1.102 . . . . 0.0 113.662 -175.856 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.546 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 7.5 tp-100 166.92 59.76 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 112.918 -1.947 . . . . 0.0 111.104 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.644 ' HA ' ' O ' ' A' ' 11' ' ' THR . 7.4 t -28.2 99.71 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.975 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.605 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 8.2 tpt . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.206 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.606 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.043 0 CA-C-O 120.788 0.328 . . . . 0.0 110.349 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.834 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 21.12 111.56 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.435 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.639 ' N ' ' O ' ' A' ' 81' ' ' ALA . 2.5 ttmt -52.04 -36.76 51.33 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 178.223 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.615 ' O ' ' HB1' ' A' ' 62' ' ' ALA . 3.5 m -136.09 178.02 7.38 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.273 -1.331 . . . . 0.0 108.863 179.116 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.707 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 2.7 p90 -158.27 157.09 31.85 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.085 -0.646 . . . . 0.0 112.572 -179.639 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.92 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 0.4 OUTLIER -127.42 24.99 6.17 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-O 122.705 1.24 . . . . 0.0 107.989 176.501 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.684 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 3.3 ptt85 -2.87 120.05 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 112.144 -2.298 . . . . 0.0 112.198 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 1.017 HG21 ' CD1' ' A' ' 25' ' ' ILE . 2.5 m -124.42 45.23 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.504 179.732 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.61 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 94.5 m -20.12 119.55 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 121.17 0.509 . . . . 0.0 110.747 -178.915 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.88 HG21 ' CE2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -122.88 -164.02 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.005 -179.169 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.736 ' HE1' ' CE1' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -28.3 138.72 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.45 -1.25 . . . . 0.0 111.323 -179.583 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 57.04 11.94 6.68 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.005 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 70' ' ' VAL . . . 74.96 39.29 38.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.141 -179.756 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.61 ' O ' ' HA ' ' A' ' 69' ' ' THR . 12.9 m-85 -73.48 114.51 11.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.95 0.405 . . . . 0.0 111.219 -179.616 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.7 mtmm -95.57 95.81 8.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.734 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.182 HG21 ' CG2' ' A' ' 25' ' ' ILE . 26.8 m -83.59 10.7 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.35 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.544 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.707 ' O ' ' CB ' ' A' ' 65' ' ' TYR . 0.3 OUTLIER 28.15 40.44 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 -177.145 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.92 ' HB3' ' CA ' ' A' ' 66' ' ' ASN . 9.9 t-20 8.96 63.17 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.991 0 CA-C-N 113.932 -1.485 . . . . 0.0 107.42 -175.627 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 1.242 ' O ' HD21 ' A' ' 12' ' ' LEU . 28.5 m170 -37.76 99.8 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.233 0 CA-C-O 122.498 1.142 . . . . 0.0 111.781 -175.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.721 HG23 ' O ' ' A' ' 78' ' ' ASN . 10.2 p -95.9 0.25 51.76 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 113.781 -1.554 . . . . 0.0 111.347 -178.85 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.639 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -167.8 146.81 4.78 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.038 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.862 ' SG ' HD12 ' A' ' 12' ' ' LEU . 84.2 m -120.4 170.19 9.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.827 0.346 . . . . 0.0 111.428 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.936 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.848 ' O ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.223 -0.293 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.266 HD21 ' O ' ' A' ' 79' ' ' HIS . 8.5 mp -145.74 127.04 14.86 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.865 0.364 . . . . 0.0 111.348 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.585 ' O ' ' C ' ' A' ' 14' ' ' GLU . 2.9 mm-40 -92.81 46.6 1.24 Allowed 'General case' 0 CA--C 1.504 -0.813 0 CA-C-O 121.799 0.809 . . . . 0.0 110.397 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.6 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 4.1 tt0 -0.59 117.63 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 113.522 -1.672 . . . . 0.0 111.419 -178.697 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.834 ' OD1' HG11 ' A' ' 76' ' ' VAL . 0.0 OUTLIER -58.76 103.93 0.39 Allowed Pre-proline 0 C--N 1.306 -1.288 0 CA-C-N 113.957 -1.474 . . . . 0.0 111.214 179.973 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.43 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 3.0 Cg_exo -74.27 14.85 0.68 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.914 2.409 . . . . 0.0 112.167 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.427 ' CE2' ' HG2' ' A' ' 71' ' ' MET . 58.9 t80 -113.42 -50.84 2.84 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.415 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 1.081 ' CD1' HG12 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -79.82 -11.17 59.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.237 -179.549 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.598 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -52.36 104.36 0.09 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.63 -179.391 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.596 ' CG ' ' O ' ' A' ' 18' ' ' PHE . 0.9 OUTLIER -123.14 166.13 19.4 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.581 179.402 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.05 76.99 0.02 OUTLIER 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.703 2.269 . . . . 0.0 112.501 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 119.81 10.23 7.8 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.516 -0.849 . . . . 0.0 112.982 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.424 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -161.38 98.1 1.28 Allowed Pre-proline 0 CA--C 1.512 -0.504 0 CA-C-O 122.141 0.972 . . . . 0.0 112.227 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.605 ' O ' ' O ' ' A' ' 25' ' ' ILE . 74.2 Cg_endo -106.55 82.45 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.549 1 C-N-CA 125.301 4.001 . . . . 0.0 111.958 -179.356 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.304 ' CG2' HG21 ' A' ' 76' ' ' VAL . 32.8 mm -42.01 -176.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.005 HD13 ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -155.92 -156.97 0.68 Allowed 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 115.028 1.492 . . . . 0.0 115.028 -173.579 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.53 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 1.3 tp-100 160.78 72.19 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 112.637 -2.074 . . . . 0.0 110.575 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.836 ' SG ' ' HB3' ' A' ' 79' ' ' HIS . 73.8 m -21.39 114.15 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.86 -179.078 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.535 ' CE ' ' OE1' ' A' ' 13' ' ' GLN . 7.1 tpp . . . . . 0 C--N 1.327 -0.402 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.547 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.828 ' O ' HG12 ' A' ' 61' ' ' VAL . 40.5 t . . . . . 0 C--O 1.231 0.085 0 CA-C-O 121.059 0.457 . . . . 0.0 110.675 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.648 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 32.33 105.59 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.515 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.777 ' N ' ' O ' ' A' ' 81' ' ' ALA . 23.1 tptt -54.49 -42.14 70.4 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.704 0.764 . . . . 0.0 108.946 177.728 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.579 ' O ' ' N ' ' A' ' 80' ' ' THR . 50.0 m -141.94 123.28 14.82 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.577 179.212 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.735 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 0.4 OUTLIER -114.14 158.86 20.73 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.639 0.733 . . . . 0.0 112.93 -177.81 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.944 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -128.55 30.35 5.16 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 176.466 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.687 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -7.6 133.49 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 112.17 -2.286 . . . . 0.0 112.401 -179.35 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 1.043 HG21 HG13 ' A' ' 25' ' ' ILE . 2.4 m -139.47 45.17 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.87 -179.739 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.667 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 21.8 m -10.75 119.18 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.649 -179.368 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 1.081 HG12 ' CD1' ' A' ' 18' ' ' PHE . 4.6 m -120.61 -169.81 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.787 0.804 . . . . 0.0 112.635 -178.721 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.614 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 11.1 mtt 37.12 -125.44 0.19 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.304 -1.317 . . . . 0.0 111.087 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -87.74 36.51 3.35 Favored Glycine 0 N--CA 1.437 -1.29 0 CA-C-N 115.399 -0.819 . . . . 0.0 112.682 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.565 ' C ' HG23 ' A' ' 69' ' ' THR . . . 104.33 21.27 9.5 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.118 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.676 ' CB ' HG22 ' A' ' 70' ' ' VAL . 3.8 m-85 -52.15 -177.84 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.607 0.241 . . . . 0.0 111.01 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.563 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -154.34 106.39 2.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 179.753 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.304 HG21 ' CG2' ' A' ' 25' ' ' ILE . 22.8 m -104.95 12.49 8.14 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.368 0 CA-C-O 121.043 0.449 . . . . 0.0 110.477 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.735 ' O ' ' CB ' ' A' ' 65' ' ' TYR . 0.4 OUTLIER 23.7 43.88 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 -178.282 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.944 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 15.6 t-20 8.2 64.74 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.967 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 -175.535 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 1.266 ' O ' HD21 ' A' ' 12' ' ' LEU . 26.5 m170 -41.36 90.61 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 122.362 1.077 . . . . 0.0 112.437 -175.412 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.667 HG23 ' O ' ' A' ' 78' ' ' ASN . 4.2 p -83.29 -4.32 58.32 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 113.946 -1.479 . . . . 0.0 110.146 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.777 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -176.23 141.04 0.42 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.616 ' SG ' ' O ' ' A' ' 11' ' ' THR . 1.5 m -114.87 151.68 33.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.825 0.345 . . . . 0.0 110.95 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.416 ' HB3' ' HB2' ' A' ' 63' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.247 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.936 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.672 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 0.2 OUTLIER . . . . . 0 CA--C 1.508 -0.66 0 CA-C-O 121.457 0.646 . . . . 0.0 111.886 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.182 HD21 ' O ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER -67.82 120.31 13.93 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.139 178.553 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.647 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.1 mt-30 -111.0 56.48 0.63 Allowed 'General case' 0 CA--C 1.501 -0.929 0 CA-C-O 122.015 0.912 . . . . 0.0 110.814 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.647 ' O ' ' O ' ' A' ' 13' ' ' GLN . 23.8 tt0 2.91 121.49 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 112.703 -2.044 . . . . 0.0 111.194 -179.617 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.683 ' ND2' ' CD2' ' A' ' 18' ' ' PHE . 1.2 t30 -48.91 99.23 0.21 Allowed Pre-proline 0 C--N 1.306 -1.318 0 CA-C-N 114.455 -1.248 . . . . 0.0 111.697 -179.289 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.596 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 40.4 Cg_endo -66.51 5.0 0.81 Allowed 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 121.88 1.72 . . . . 0.0 109.765 178.031 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.612 ' CZ ' ' SD ' ' A' ' 71' ' ' MET . 0.6 OUTLIER -103.65 -56.93 2.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 113.883 -1.508 . . . . 0.0 110.514 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.683 ' CD2' ' ND2' ' A' ' 15' ' ' ASN . 0.6 OUTLIER -87.63 -2.33 58.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.007 -179.666 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.774 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.3 m -60.0 86.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.645 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.756 ' CG ' ' HB3' ' A' ' 23' ' ' ALA . 3.4 pt20 -108.67 154.37 41.72 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.788 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -57.14 66.74 0.04 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.23 0 C-N-CA 122.563 2.175 . . . . 0.0 111.232 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.631 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 149.56 -15.36 1.09 Allowed Glycine 0 N--CA 1.449 -0.438 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.681 -179.031 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.756 ' HB3' ' CG ' ' A' ' 20' ' ' GLN . . . -148.21 99.39 3.68 Favored Pre-proline 0 CA--C 1.51 -0.576 0 CA-C-O 122.007 0.908 . . . . 0.0 110.822 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.774 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 62.5 Cg_endo -104.57 66.36 0.02 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.692 0 C-N-CA 124.718 3.612 . . . . 0.0 113.755 -178.052 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.149 ' CG2' HG21 ' A' ' 76' ' ' VAL . 15.4 mm -39.75 -179.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 N-CA-C 112.789 0.662 . . . . 0.0 112.789 179.174 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.001 ' HB3' HD23 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -148.52 -163.01 1.68 Allowed 'General case' 0 CA--C 1.497 -1.078 0 CA-C-O 122.624 1.202 . . . . 0.0 113.992 -176.073 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.586 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 8.6 tp60 167.77 62.66 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 112.501 -2.136 . . . . 0.0 111.005 179.439 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.672 ' HA ' ' O ' ' A' ' 11' ' ' THR . 1.2 t -28.74 99.72 0.02 OUTLIER 'General case' 0 C--O 1.23 0.075 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.065 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.575 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 19.0 tpp . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.037 -179.017 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.68 ' O ' HG13 ' A' ' 61' ' ' VAL . 11.4 p . . . . . 0 C--O 1.231 0.095 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.64 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 24.54 106.88 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.456 -179.344 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.804 ' N ' ' O ' ' A' ' 81' ' ' ALA . 9.7 ttmm -55.25 -42.66 73.78 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 177.905 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.512 ' N ' ' HB3' ' A' ' 81' ' ' ALA . 0.7 OUTLIER -136.9 136.81 38.98 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.251 -1.341 . . . . 0.0 108.901 178.989 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.692 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 6.2 p90 -126.2 160.94 28.87 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.141 0.496 . . . . 0.0 112.264 -178.045 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.89 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 1.2 t30 -126.08 27.03 6.39 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-O 122.51 1.148 . . . . 0.0 107.945 176.547 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.594 ' HG3' ' HA ' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -9.57 122.94 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 112.466 -2.152 . . . . 0.0 111.367 -179.46 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.958 HG21 ' CD1' ' A' ' 25' ' ' ILE . 2.4 m -119.47 40.81 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.186 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.707 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 48.0 m -18.08 118.39 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.282 -179.246 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.906 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.2 OUTLIER -131.76 -167.37 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-O 121.608 0.718 . . . . 0.0 112.215 -178.544 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.634 ' H ' HG12 ' A' ' 70' ' ' VAL . 0.0 OUTLIER 42.32 -131.57 0.53 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.755 -179.839 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -83.7 36.5 2.82 Favored Glycine 0 N--CA 1.435 -1.394 0 CA-C-N 115.263 -0.881 . . . . 0.0 112.099 179.378 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 94.55 47.0 2.84 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.034 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.707 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.5 m-85 -78.28 178.53 7.57 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.657 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -155.59 110.18 2.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.984 0.421 . . . . 0.0 111.669 -179.876 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.149 HG21 ' CG2' ' A' ' 25' ' ' ILE . 10.1 m -107.5 10.59 9.12 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.416 0 CA-C-O 121.288 0.566 . . . . 0.0 109.686 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.772 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER 28.54 40.12 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 -177.601 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.89 ' HB3' ' CA ' ' A' ' 66' ' ' ASN . 13.9 t-20 5.95 62.26 0.0 OUTLIER 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 -176.105 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 1.182 ' O ' HD21 ' A' ' 12' ' ' LEU . 28.4 m170 -37.17 103.67 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.252 0 CA-C-O 122.409 1.1 . . . . 0.0 112.026 -175.239 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.76 HG23 ' O ' ' A' ' 78' ' ' ASN . 7.8 p -102.44 -5.58 23.92 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 113.777 -1.556 . . . . 0.0 111.32 -178.829 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.804 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -167.2 135.34 2.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.639 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 15.6 m -115.84 155.14 28.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.832 0.349 . . . . 0.0 111.095 -179.109 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.487 ' CG ' ' O ' ' A' ' 83' ' ' HIS . 2.3 p-80 . . . . . 0 C--N 1.331 -0.226 0 CA-C-O 120.964 0.411 . . . . 0.0 111.075 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.648 ' O ' ' N ' ' A' ' 29' ' ' MET . 9.2 t . . . . . 0 CA--C 1.512 -0.506 0 CA-C-O 120.821 0.343 . . . . 0.0 110.098 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.853 HD23 HD13 ' A' ' 26' ' ' LEU . 4.6 mp -79.76 136.72 36.82 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.554 -179.532 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.629 ' O ' ' O ' ' A' ' 14' ' ' GLU . 42.9 mt-30 -115.39 60.53 0.7 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.212 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.629 ' O ' ' O ' ' A' ' 13' ' ' GLN . 20.9 tt0 2.8 121.2 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.752 -179.504 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.864 ' OD1' HG11 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -51.71 113.07 3.67 Favored Pre-proline 0 C--N 1.306 -1.311 0 CA-C-N 113.866 -1.515 . . . . 0.0 112.139 -179.668 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_endo -79.86 18.16 1.18 Allowed 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.418 2.079 . . . . 0.0 111.607 178.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.574 ' CD2' ' SD ' ' A' ' 71' ' ' MET . 15.6 t80 -124.88 -55.28 1.61 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.487 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 1.213 ' CD1' HG12 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -73.03 -16.17 61.5 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.829 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.489 ' HB3' ' O ' ' A' ' 15' ' ' ASN . 4.2 p -49.18 88.05 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.627 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.599 ' O ' ' N ' ' A' ' 22' ' ' GLY . 4.3 mt-30 -113.58 160.21 32.57 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.063 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.14 67.21 0.03 OUTLIER 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.757 2.304 . . . . 0.0 112.19 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.599 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 144.54 -5.45 1.58 Allowed Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.811 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.435 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -153.46 105.32 2.56 Favored Pre-proline 0 CA--C 1.515 -0.376 0 CA-C-O 122.006 0.907 . . . . 0.0 111.858 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.672 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.4 Cg_endo -102.95 68.26 0.03 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.457 0 C-N-CA 124.904 3.736 . . . . 0.0 112.528 -179.332 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.216 ' CG2' HG21 ' A' ' 76' ' ' VAL . 24.4 mm -39.82 -174.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -179.648 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.035 HD23 ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -153.63 -159.21 0.95 Allowed 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -174.858 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.492 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 1.9 tt0 160.16 101.61 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 112.661 -2.063 . . . . 0.0 110.062 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.55 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -47.11 103.71 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.115 -179.005 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.648 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.935 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.643 ' O ' ' CE1' ' A' ' 83' ' ' HIS . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.175 0 CA-C-O 120.7 0.286 . . . . 0.0 110.57 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.661 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . -5.71 102.73 0.01 OUTLIER 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 122.071 0.938 . . . . 0.0 112.317 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.858 ' HG3' ' C ' ' A' ' 81' ' ' ALA . 0.1 OUTLIER -50.8 -44.85 59.05 Favored 'General case' 0 CA--C 1.49 -1.33 0 CA-C-N 113.613 -1.63 . . . . 0.0 108.597 178.028 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.678 ' O ' ' N ' ' A' ' 80' ' ' THR . 37.2 m -138.96 112.48 8.25 Favored 'General case' 0 N--CA 1.425 -1.677 0 CA-C-N 113.625 -1.625 . . . . 0.0 110.395 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.696 ' CG ' ' CG ' ' A' ' 77' ' ' GLU . 0.9 OUTLIER -99.66 164.25 12.14 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.843 -178.823 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.795 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -134.65 29.16 3.56 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 177.317 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.563 ' O ' ' O ' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -6.18 129.98 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 112.099 -2.319 . . . . 0.0 112.487 -179.678 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 1.049 HG21 HG13 ' A' ' 25' ' ' ILE . 3.2 m -141.04 47.31 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.593 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.677 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 20.1 m -6.92 118.64 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.138 -179.075 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 1.213 HG12 ' CD1' ' A' ' 18' ' ' PHE . 5.4 m -119.01 -169.48 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.867 0.841 . . . . 0.0 112.851 -178.728 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.593 ' HG2' HG23 ' A' ' 70' ' ' VAL . 3.0 mmt 34.51 -127.86 0.09 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.212 -1.358 . . . . 0.0 111.517 179.619 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -83.02 35.81 2.73 Favored Glycine 0 N--CA 1.44 -1.06 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.585 -179.765 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.527 ' C ' HG23 ' A' ' 69' ' ' THR . . . 103.33 19.24 12.74 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.869 -0.682 . . . . 0.0 112.027 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.738 ' HB2' ' CG2' ' A' ' 70' ' ' VAL . 3.0 m-85 -52.03 -176.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.656 0.265 . . . . 0.0 111.038 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.582 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 18.9 mtmm -153.36 94.85 1.86 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.902 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.216 HG21 ' CG2' ' A' ' 25' ' ' ILE . 31.7 m -86.44 10.77 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.359 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.633 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.727 ' O ' ' HD2' ' A' ' 79' ' ' HIS . 0.1 OUTLIER 26.46 42.01 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 105.666 -1.975 . . . . 0.0 105.666 -177.632 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.95 ' HB2' HG13 ' A' ' 68' ' ' VAL . 51.6 t30 -0.86 69.98 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.846 0 CA-C-N 113.51 -1.677 . . . . 0.0 109.16 -174.209 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 1.031 ' N ' HD12 ' A' ' 26' ' ' LEU . 41.3 m170 -43.34 111.76 0.31 Allowed 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 113.472 -1.694 . . . . 0.0 113.5 -176.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.678 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.5 p -91.71 -33.58 14.98 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 113.731 -1.577 . . . . 0.0 108.413 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.858 ' C ' ' HG3' ' A' ' 63' ' ' LYS . . . -149.55 150.04 31.64 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 177.798 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.9 OUTLIER -129.35 130.41 46.04 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.075 0.464 . . . . 0.0 111.674 -179.612 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.645 ' HB3' ' HD2' ' A' ' 63' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.181 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.615 -179.718 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.768 0.318 . . . . 0.0 111.218 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.888 HD21 ' O ' ' A' ' 79' ' ' HIS . 6.0 mp -54.66 130.86 41.92 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.977 178.912 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.671 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.8 mm-40 -127.57 62.31 1.38 Allowed 'General case' 0 CA--C 1.506 -0.727 0 CA-C-O 122.357 1.075 . . . . 0.0 111.734 -179.853 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.686 ' O ' ' HD3' ' A' ' 16' ' ' PRO . 0.9 OUTLIER 6.46 125.87 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 112.241 -2.254 . . . . 0.0 112.295 179.538 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.772 ' ND2' HG11 ' A' ' 76' ' ' VAL . 0.5 OUTLIER -56.15 100.2 0.21 Allowed Pre-proline 0 C--N 1.314 -0.944 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.889 179.782 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.686 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 66.0 Cg_endo -72.86 4.81 3.35 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 121.738 1.625 . . . . 0.0 109.315 177.342 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.542 ' CD2' ' CE1' ' A' ' 18' ' ' PHE . 1.1 t80 -106.02 -57.87 1.99 Allowed 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 113.724 -1.58 . . . . 0.0 110.364 -179.839 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.945 ' CG ' HG21 ' A' ' 70' ' ' VAL . 3.6 m-30 -81.58 0.67 37.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.622 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.49 102.95 0.6 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.012 179.899 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.607 ' HB3' ' HD2' ' A' ' 21' ' ' PRO . 12.9 mt-30 -111.54 162.21 22.02 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.286 179.607 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.607 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 24.9 Cg_endo -60.47 66.37 0.08 OUTLIER 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.647 2.232 . . . . 0.0 111.812 179.773 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.537 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 147.14 -10.96 1.37 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.345 -179.623 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.473 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -146.89 106.38 3.95 Favored Pre-proline 0 CA--C 1.514 -0.441 0 CA-C-O 121.858 0.837 . . . . 0.0 111.349 -179.662 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.569 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 97.3 Cg_endo -104.03 75.44 0.03 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.573 0 C-N-CA 124.752 3.634 . . . . 0.0 113.083 -178.48 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.268 ' CG2' HG21 ' A' ' 76' ' ' VAL . 15.5 mm -44.47 -175.35 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.911 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.003 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -146.04 -166.36 2.44 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 -176.026 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.534 ' O ' ' C ' ' A' ' 28' ' ' CYS . 1.7 tt0 164.32 75.17 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 112.501 -2.136 . . . . 0.0 111.993 178.735 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.707 ' SG ' HD12 ' A' ' 12' ' ' LEU . 14.1 m -23.53 101.0 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.709 179.211 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.3 ttt . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.894 -179.388 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.761 HG22 ' O ' ' A' ' 61' ' ' VAL . 2.2 p . . . . . 0 CA--C 1.522 -0.106 0 CA-C-O 120.728 0.299 . . . . 0.0 110.214 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.594 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 10.64 104.29 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.073 -179.224 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 1.046 ' N ' ' O ' ' A' ' 81' ' ' ALA . 70.4 tttt -53.35 -36.29 61.18 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 178.148 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.468 ' N ' ' HB3' ' A' ' 81' ' ' ALA . 8.0 m -139.08 163.01 33.54 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.326 -1.306 . . . . 0.0 108.558 178.867 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.764 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.7 OUTLIER -144.57 159.29 43.04 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.616 -179.236 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.878 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 0.9 OUTLIER -124.28 24.83 7.94 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 122.677 1.227 . . . . 0.0 107.817 176.88 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.551 ' O ' ' O ' ' A' ' 66' ' ' ASN . 3.9 ttt180 1.0 121.53 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 111.997 -2.365 . . . . 0.0 112.04 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 1.003 HG21 ' CD1' ' A' ' 25' ' ' ILE . 1.5 m -128.27 39.81 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.893 179.668 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.664 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 47.8 m -21.45 118.61 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.062 -179.454 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.945 HG21 ' CG ' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -121.29 -168.87 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.775 0.797 . . . . 0.0 112.636 -178.767 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.473 ' HB2' ' CD2' ' A' ' 74' ' ' PHE . 61.0 mmm 30.17 -131.45 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.127 -1.397 . . . . 0.0 111.571 -179.918 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -63.04 -0.39 3.03 Favored Glycine 0 N--CA 1.442 -0.923 0 CA-C-N 115.342 -0.845 . . . . 0.0 113.271 -179.694 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.532 ' N ' ' O ' ' A' ' 70' ' ' VAL . . . 119.62 37.11 0.8 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.156 -179.782 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.664 ' O ' ' HA ' ' A' ' 69' ' ' THR . 32.2 m-85 -64.08 -178.67 0.36 Allowed 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.498 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.619 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -153.87 95.13 1.84 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -179.576 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.268 HG21 ' CG2' ' A' ' 25' ' ' ILE . 14.1 m -92.15 16.89 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.494 -1.201 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.323 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.764 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 22.38 45.12 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 -177.934 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.878 ' HB3' ' CA ' ' A' ' 66' ' ' ASN . 9.0 t-20 3.16 71.13 0.0 OUTLIER 'General case' 0 CA--C 1.498 -1.041 0 CA-C-N 114.407 -1.269 . . . . 0.0 107.601 -175.226 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 1.003 ' N ' HD12 ' A' ' 26' ' ' LEU . 33.2 m170 -41.99 115.06 0.61 Allowed 'General case' 0 C--N 1.304 -1.383 0 CA-C-O 122.372 1.082 . . . . 0.0 111.475 -176.277 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.786 HG23 ' O ' ' A' ' 78' ' ' ASN . 11.0 p -114.02 -2.83 13.42 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 113.779 -1.555 . . . . 0.0 110.761 -178.578 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 1.046 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -168.35 112.48 0.61 Allowed 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.79 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.525 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.5 OUTLIER -99.87 153.96 18.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.692 0.282 . . . . 0.0 110.838 -179.284 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.738 ' NE2' HG13 ' A' ' 61' ' ' VAL . 1.6 p80 . . . . . 0 C--N 1.329 -0.292 0 CA-C-O 120.942 0.401 . . . . 0.0 111.092 -179.975 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.831 ' O ' ' N ' ' A' ' 29' ' ' MET . 0.1 OUTLIER . . . . . 0 CA--C 1.508 -0.666 0 CA-C-O 121.158 0.504 . . . . 0.0 110.157 . . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.281 HD21 ' O ' ' A' ' 79' ' ' HIS . 0.8 OUTLIER -74.98 135.77 41.33 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.462 -179.224 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.635 ' O ' ' O ' ' A' ' 14' ' ' GLU . 6.8 mt-30 -122.18 54.15 1.19 Allowed 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 121.715 0.769 . . . . 0.0 109.707 177.808 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.635 ' O ' ' O ' ' A' ' 13' ' ' GLN . 5.0 tt0 -2.93 125.66 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 113.495 -1.684 . . . . 0.0 111.445 -178.546 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.754 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.5 OUTLIER -62.16 106.0 0.74 Allowed Pre-proline 0 C--N 1.309 -1.173 0 CA-C-N 114.335 -1.302 . . . . 0.0 112.274 -179.176 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.407 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 4.3 Cg_exo -77.19 10.88 2.25 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 122.531 2.154 . . . . 0.0 109.415 177.453 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.564 ' CE1' ' SD ' ' A' ' 71' ' ' MET . 0.9 OUTLIER -106.48 -61.15 1.56 Allowed 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.138 -1.392 . . . . 0.0 111.296 -179.196 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.811 ' CG ' HG21 ' A' ' 70' ' ' VAL . 5.2 m-85 -81.72 -3.22 53.14 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.714 -178.718 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.707 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 58.4 p -58.75 89.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.974 0.416 . . . . 0.0 110.723 -179.886 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.589 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -88.57 165.99 25.18 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.933 179.731 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.453 ' CD ' ' HG3' ' A' ' 20' ' ' GLN . 22.6 Cg_endo -61.43 59.02 0.11 Allowed 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 122.348 2.032 . . . . 0.0 111.452 179.638 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.589 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 157.39 -16.53 0.34 Allowed Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 115.773 -0.648 . . . . 0.0 112.622 -179.534 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.499 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -145.22 109.25 4.6 Favored Pre-proline 0 CA--C 1.517 -0.324 0 CA-C-O 121.966 0.889 . . . . 0.0 112.168 -179.316 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.707 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 69.0 Cg_endo -101.81 78.81 0.04 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.284 0 C-N-CA 124.912 3.741 . . . . 0.0 113.401 -179.086 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.185 ' CG2' HG21 ' A' ' 76' ' ' VAL . 5.6 mm -39.18 -176.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.992 HD13 ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -152.98 -160.12 1.09 Allowed 'General case' 0 CA--C 1.503 -0.856 0 CA-C-O 122.509 1.147 . . . . 0.0 113.955 -175.974 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.565 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 2.4 tt0 162.75 78.24 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 112.853 -1.976 . . . . 0.0 111.339 179.392 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.802 ' HA ' ' O ' ' A' ' 11' ' ' THR . 77.1 m -25.52 100.24 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.174 179.885 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.831 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.942 179.8 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.79 ' O ' HG12 ' A' ' 61' ' ' VAL . 56.7 t . . . . . 0 CA--C 1.519 -0.22 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.818 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 10.23 108.36 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.514 -0.766 . . . . 0.0 112.196 -179.621 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.821 ' N ' ' O ' ' A' ' 81' ' ' ALA . 36.5 tttt -51.81 -33.36 35.41 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.582 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.54 ' CB ' ' OG1' ' A' ' 80' ' ' THR . 13.8 m -141.3 165.3 27.89 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.943 179.075 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.656 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 0.3 OUTLIER -147.22 161.83 40.14 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.239 0.542 . . . . 0.0 111.936 -179.356 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.806 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.1 OUTLIER -134.5 29.59 3.57 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-O 122.74 1.257 . . . . 0.0 107.698 176.787 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.555 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -9.76 128.73 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 112.029 -2.35 . . . . 0.0 112.163 -179.458 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 1.038 HG21 ' CD1' ' A' ' 25' ' ' ILE . 4.3 m -136.06 48.35 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 114.812 -1.086 . . . . 0.0 110.282 179.883 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.605 ' C ' ' O ' ' A' ' 68' ' ' VAL . 89.1 m -20.08 118.27 0.03 OUTLIER 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.048 -179.304 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.811 HG21 ' CG ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -120.48 -172.05 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-O 121.428 0.632 . . . . 0.0 112.525 -178.039 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.564 ' SD ' ' CE1' ' A' ' 17' ' ' PHE . 29.0 mmm 33.2 -127.64 0.06 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.791 -1.095 . . . . 0.0 111.147 -179.275 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -78.71 9.88 34.38 Favored Glycine 0 N--CA 1.438 -1.218 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.651 -179.817 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.555 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 128.68 24.76 1.08 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.763 179.969 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.567 ' O ' ' HA ' ' A' ' 69' ' ' THR . 5.7 m-30 -69.7 118.49 12.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.796 0.331 . . . . 0.0 110.999 -179.791 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.442 ' HB3' ' CD ' ' A' ' 67' ' ' ARG . 0.4 OUTLIER -105.87 110.64 23.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.071 0.462 . . . . 0.0 111.892 -179.668 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.185 HG21 ' CG2' ' A' ' 25' ' ' ILE . 17.7 m -95.21 12.05 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.439 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.44 178.958 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.72 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER 29.69 39.34 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 105.47 -2.048 . . . . 0.0 105.47 -176.636 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.874 ' C ' HD12 ' A' ' 26' ' ' LEU . 55.3 t30 3.11 64.11 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.682 0 CA-C-N 113.341 -1.754 . . . . 0.0 108.405 -174.562 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 1.281 ' O ' HD21 ' A' ' 12' ' ' LEU . 35.8 m170 -38.0 114.05 0.32 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 113.399 -1.728 . . . . 0.0 112.818 -176.689 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.54 ' OG1' ' CB ' ' A' ' 64' ' ' SER . 3.0 p -98.54 -7.3 28.53 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 114.388 -1.278 . . . . 0.0 110.339 -179.734 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.821 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -169.32 136.8 1.8 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.89 178.741 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.915 ' SG ' HD12 ' A' ' 12' ' ' LEU . 6.9 m -119.67 119.37 33.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.653 0.263 . . . . 0.0 110.636 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.483 0 CA-C-O 120.917 0.389 . . . . 0.0 110.156 178.996 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.67 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.235 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 . . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.947 HD23 HD13 ' A' ' 26' ' ' LEU . 3.3 mp -116.21 141.23 48.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.002 0.43 . . . . 0.0 111.034 179.825 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.735 ' CG ' ' HA ' ' A' ' 29' ' ' MET . 2.7 mt-30 -98.93 45.75 1.0 Allowed 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 121.292 0.568 . . . . 0.0 110.896 179.778 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.653 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 0.9 OUTLIER -5.92 117.92 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.835 -178.729 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.796 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.5 OUTLIER -58.26 103.53 0.37 Allowed Pre-proline 0 C--N 1.304 -1.378 0 CA-C-N 114.063 -1.426 . . . . 0.0 112.455 -178.659 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.558 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 86.2 Cg_endo -77.4 4.36 5.99 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 122.119 1.879 . . . . 0.0 109.289 177.4 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.607 ' CE2' ' SD ' ' A' ' 71' ' ' MET . 0.8 OUTLIER -95.08 -64.41 1.07 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 113.659 -1.61 . . . . 0.0 109.742 179.563 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.831 ' CG ' HG21 ' A' ' 70' ' ' VAL . 7.8 m-85 -74.82 -4.4 37.55 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.994 179.339 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.61 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -57.69 88.57 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.542 179.856 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.723 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.8 OUTLIER -95.3 155.9 38.3 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.057 179.715 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -48.98 69.04 0.02 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.726 2.284 . . . . 0.0 111.754 179.709 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.723 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 137.25 -0.45 2.87 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.77 -179.572 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.544 ' O ' ' HA ' ' A' ' 19' ' ' SER . . . -153.94 104.39 2.47 Favored Pre-proline 0 CA--C 1.517 -0.311 0 CA-C-O 121.806 0.812 . . . . 0.0 112.178 -179.551 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.616 ' O ' ' O ' ' A' ' 25' ' ' ILE . 63.2 Cg_endo -104.64 76.64 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 125.133 3.889 . . . . 0.0 113.491 -178.725 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.167 ' CG2' HG21 ' A' ' 76' ' ' VAL . 10.1 mm -40.64 -173.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 179.728 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.027 HD23 ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -151.51 -162.73 1.59 Allowed 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -176.298 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.648 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 35.7 tp60 168.18 50.97 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 113.099 -1.864 . . . . 0.0 111.967 179.55 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.605 ' O ' ' O ' ' A' ' 27' ' ' GLN . 0.8 OUTLIER 26.55 119.14 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 178.705 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.735 ' HA ' ' CG ' ' A' ' 13' ' ' GLN . 1.9 ttp . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.304 177.921 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.534 ' O ' ' O ' ' A' ' 62' ' ' ALA . 2.2 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.811 0.338 . . . . 0.0 110.83 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.66 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 26.11 106.88 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.749 0 CA-C-O 121.993 0.902 . . . . 0.0 112.471 -179.969 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.883 ' HG3' ' CB ' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -49.46 -47.14 48.57 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 113.724 -1.58 . . . . 0.0 107.708 177.023 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.642 ' OG ' ' HB3' ' A' ' 81' ' ' ALA . 2.1 p -128.52 156.19 43.67 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 113.193 -1.822 . . . . 0.0 109.243 179.304 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.704 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -141.31 160.81 39.34 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.59 0.709 . . . . 0.0 112.424 -178.308 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.785 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -127.87 28.32 5.6 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-O 122.703 1.239 . . . . 0.0 107.684 177.378 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.524 ' HD3' ' HB3' ' A' ' 75' ' ' LYS . 0.9 OUTLIER -9.23 126.27 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 112.115 -2.311 . . . . 0.0 112.033 -179.688 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.993 HG21 HG13 ' A' ' 25' ' ' ILE . 3.1 m -129.55 43.03 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.212 179.466 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.577 ' C ' ' O ' ' A' ' 68' ' ' VAL . 53.9 m -16.16 118.95 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.136 -179.303 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.831 HG21 ' CG ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -125.75 -169.23 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.856 -179.574 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.607 ' SD ' ' CE2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER 41.91 -135.57 0.3 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.977 -1.011 . . . . 0.0 110.862 -179.704 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -78.94 21.14 4.13 Favored Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.667 179.935 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 114.88 41.09 0.86 Allowed Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.296 -179.982 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.562 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 3.2 m-85 -70.21 -175.73 1.03 Allowed 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 179.894 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.585 ' CD ' ' N ' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -160.15 94.39 1.1 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -179.552 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.167 HG21 ' CG2' ' A' ' 25' ' ' ILE . 31.4 m -88.98 11.8 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.491 -1.309 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.014 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.758 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 27.14 42.35 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 105.336 -2.098 . . . . 0.0 105.336 -176.81 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.914 ' HB2' HG13 ' A' ' 68' ' ' VAL . 57.4 t30 -1.69 67.21 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.828 0 CA-C-N 113.302 -1.772 . . . . 0.0 108.597 -174.414 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 1.016 ' N ' HD12 ' A' ' 26' ' ' LEU . 37.6 m170 -34.27 122.33 0.49 Allowed 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 112.747 -2.024 . . . . 0.0 114.094 -176.493 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.554 ' OG1' ' CB ' ' A' ' 64' ' ' SER . 6.5 p -107.68 -34.25 7.05 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 113.483 -1.69 . . . . 0.0 109.513 178.362 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.883 ' CB ' ' HG3' ' A' ' 63' ' ' LYS . . . -143.17 143.41 31.78 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.808 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.578 ' CA ' ' HG2' ' A' ' 63' ' ' LYS . 1.2 m -129.6 129.86 44.92 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.943 -179.318 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.818 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 0.3 OUTLIER . . . . . 0 CA--C 1.522 -0.108 0 CA-C-O 121.07 0.462 . . . . 0.0 111.08 179.278 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.881 ' O ' HD12 ' A' ' 12' ' ' LEU . 1.2 t . . . . . 0 CA--C 1.518 -0.26 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.895 HD23 HD13 ' A' ' 26' ' ' LEU . 11.1 mp -133.55 129.95 37.77 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.001 0.429 . . . . 0.0 110.919 179.644 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.655 ' O ' ' O ' ' A' ' 14' ' ' GLU . 28.1 mt-30 -106.64 55.51 0.66 Allowed 'General case' 0 CA--C 1.504 -0.824 0 CA-C-O 121.444 0.64 . . . . 0.0 111.717 -179.083 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.655 ' O ' ' O ' ' A' ' 13' ' ' GLN . 26.1 tt0 0.03 122.66 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 113.872 -1.513 . . . . 0.0 111.279 -179.611 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.845 ' ND2' ' CZ ' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -51.44 104.34 0.42 Allowed Pre-proline 0 C--N 1.303 -1.422 0 CA-C-N 113.916 -1.493 . . . . 0.0 112.826 -179.116 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.695 ' HD2' ' CE1' ' A' ' 17' ' ' PHE . 55.3 Cg_endo -69.27 7.7 0.81 Allowed 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.161 1.908 . . . . 0.0 112.121 178.943 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.845 ' CZ ' ' ND2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -112.42 -58.95 2.07 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.22 178.778 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.867 ' CD2' HG13 ' A' ' 70' ' ' VAL . 0.4 OUTLIER -71.34 -17.03 62.46 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.556 -178.929 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.575 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -51.13 84.07 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.965 -179.606 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.57 ' O ' ' N ' ' A' ' 22' ' ' GLY . 11.4 mm100 -118.51 159.93 41.91 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.06 -179.855 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.474 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 12.9 Cg_endo -55.3 72.84 0.03 OUTLIER 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.868 2.379 . . . . 0.0 111.515 179.298 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.57 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 142.92 -13.35 2.39 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.961 -0.637 . . . . 0.0 111.903 -179.344 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.486 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -150.55 102.22 3.09 Favored Pre-proline 0 CA--C 1.511 -0.525 0 CA-C-O 122.023 0.916 . . . . 0.0 111.826 -179.79 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.665 ' O ' ' O ' ' A' ' 25' ' ' ILE . 87.3 Cg_endo -104.18 60.47 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.543 0 C-N-CA 124.873 3.715 . . . . 0.0 112.433 -179.112 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.168 ' CG2' HG21 ' A' ' 76' ' ' VAL . 19.9 mm -38.63 -175.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-N 114.916 -1.038 . . . . 0.0 113.544 -179.839 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.071 HD23 ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.13 -160.85 1.2 Allowed 'General case' 0 CA--C 1.503 -0.862 0 CA-C-O 122.398 1.094 . . . . 0.0 113.699 -174.99 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.571 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 16.6 tt0 163.63 66.2 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 113.179 -1.828 . . . . 0.0 111.261 179.298 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.683 ' HA ' ' O ' ' A' ' 11' ' ' THR . 38.9 t -18.96 115.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.573 179.874 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.511 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 0.6 OUTLIER . . . . . 0 C--N 1.324 -0.503 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.354 179.629 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.65 ' O ' ' O ' ' A' ' 62' ' ' ALA . 31.0 m . . . . . 0 N--CA 1.452 -0.347 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.65 ' O ' ' O ' ' A' ' 61' ' ' VAL . . . 24.06 107.93 0.0 OUTLIER 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.976 -178.621 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.795 ' N ' ' O ' ' A' ' 81' ' ' ALA . 1.2 ttmt -51.38 -36.24 42.43 Favored 'General case' 0 CA--C 1.503 -0.855 0 CA-C-O 121.797 0.808 . . . . 0.0 109.452 179.614 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.591 ' OG ' ' HB3' ' A' ' 81' ' ' ALA . 2.0 p -143.84 142.16 30.7 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.193 -1.367 . . . . 0.0 109.044 178.864 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.672 ' CG ' ' CG ' ' A' ' 77' ' ' GLU . 1.1 p90 -129.54 165.92 20.72 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.672 0.749 . . . . 0.0 112.601 -178.775 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.789 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -133.96 27.48 3.9 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 114.401 -1.272 . . . . 0.0 107.76 176.688 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.674 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -6.86 121.91 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 112.077 -2.329 . . . . 0.0 112.053 179.911 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 1.055 HG21 ' CD1' ' A' ' 25' ' ' ILE . 3.8 m -129.16 44.12 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.055 179.516 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.71 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 36.6 m -18.09 118.0 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.68 -178.799 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.867 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -110.92 -163.42 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.772 0.796 . . . . 0.0 111.812 179.538 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.644 ' HG3' ' CD2' ' A' ' 74' ' ' PHE . 2.4 ptm -34.14 145.57 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.393 -1.276 . . . . 0.0 111.519 -179.555 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 54.3 10.56 2.01 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.659 -0.782 . . . . 0.0 111.977 -179.532 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.501 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 80.68 33.84 29.62 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.192 -179.854 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.71 ' O ' ' HA ' ' A' ' 69' ' ' THR . 9.6 m-85 -65.44 110.29 2.62 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.988 0.423 . . . . 0.0 111.016 -179.873 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.498 ' CD ' ' OG1' ' A' ' 69' ' ' THR . 9.6 mmmt -94.1 98.48 11.02 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.525 -179.837 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.168 HG21 ' CG2' ' A' ' 25' ' ' ILE . 30.1 m -87.53 10.98 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.489 -1.381 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.136 179.149 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.783 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER 27.45 41.43 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 -177.396 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 1.01 ' HB2' HG13 ' A' ' 68' ' ' VAL . 45.0 t30 -0.67 64.95 0.0 OUTLIER 'General case' 0 CA--C 1.501 -0.916 0 CA-C-N 113.371 -1.741 . . . . 0.0 108.542 -174.48 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 1.001 ' N ' HD12 ' A' ' 26' ' ' LEU . 36.9 m170 -37.12 122.05 0.84 Allowed 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 112.75 -2.023 . . . . 0.0 113.746 -176.503 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.573 ' OG1' ' HB2' ' A' ' 64' ' ' SER . 2.6 p -108.29 -8.86 15.59 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 113.504 -1.68 . . . . 0.0 109.622 178.718 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.795 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -173.99 137.52 0.57 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.81 179.001 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.577 ' C ' ' ND1' ' A' ' 83' ' ' HIS . 1.8 t -127.7 131.26 49.79 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.7 0.286 . . . . 0.0 111.164 179.855 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.732 ' ND1' ' HB2' ' A' ' 63' ' ' LYS . 0.7 OUTLIER . . . . . 0 C--N 1.324 -0.541 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.642 -179.821 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.616 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.456 -0.13 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 . . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.876 HD23 HD13 ' A' ' 26' ' ' LEU . 1.5 mp -114.94 140.88 48.65 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.714 0.293 . . . . 0.0 110.368 179.633 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.761 ' HG3' ' HA ' ' A' ' 29' ' ' MET . 3.1 mm-40 -101.2 50.08 0.87 Allowed 'General case' 0 CA--C 1.499 -0.991 0 CA-C-O 121.936 0.874 . . . . 0.0 111.204 -179.41 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.651 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 2.2 tt0 -0.25 120.12 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 113.183 -1.826 . . . . 0.0 111.554 -179.4 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.822 ' OD1' HG11 ' A' ' 76' ' ' VAL . 0.0 OUTLIER -52.55 120.29 17.82 Favored Pre-proline 0 C--N 1.308 -1.204 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.56 -179.815 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -82.34 16.93 1.67 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.479 2.119 . . . . 0.0 112.094 179.592 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.629 ' CE2' ' HG3' ' A' ' 71' ' ' MET . 86.9 t80 -123.73 -54.69 1.74 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.874 -179.921 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.957 ' CD1' HG12 ' A' ' 70' ' ' VAL . 0.3 OUTLIER -75.09 -7.47 53.83 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.318 -179.353 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.625 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -60.0 101.58 0.13 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.651 -179.308 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.593 ' CB ' ' HD2' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -115.41 177.45 1.19 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.265 179.334 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.593 ' HD2' ' CB ' ' A' ' 20' ' ' GLN . 59.5 Cg_endo -71.44 60.38 2.64 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.484 2.122 . . . . 0.0 111.748 179.566 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 149.65 -10.06 0.92 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.499 -179.576 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -146.95 99.4 4.0 Favored Pre-proline 0 CA--C 1.509 -0.625 0 CA-C-O 122.15 0.976 . . . . 0.0 112.021 -179.657 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.63 ' O ' ' O ' ' A' ' 25' ' ' ILE . 98.0 Cg_endo -104.8 79.94 0.02 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.707 0 C-N-CA 125.094 3.863 . . . . 0.0 112.687 -179.054 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.233 ' CG2' HG21 ' A' ' 76' ' ' VAL . 24.3 mm -42.56 -173.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-N 115.509 -0.769 . . . . 0.0 113.019 -179.939 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.005 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -152.97 -159.18 0.97 Allowed 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 -174.822 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.671 ' O ' ' O ' ' A' ' 28' ' ' CYS . 4.0 tm0? 166.04 56.96 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 112.603 -2.09 . . . . 0.0 111.143 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.671 ' O ' ' O ' ' A' ' 27' ' ' GLN . 0.8 OUTLIER 18.37 119.16 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.918 179.876 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.761 ' HA ' ' HG3' ' A' ' 13' ' ' GLN . 5.8 tmm? . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.899 179.041 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.839 HG22 ' O ' ' A' ' 61' ' ' VAL . 1.3 p . . . . . 0 CA--C 1.521 -0.156 0 CA-C-O 120.963 0.411 . . . . 0.0 110.298 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.745 ' HB1' ' O ' ' A' ' 64' ' ' SER . . . 3.03 103.32 0.01 OUTLIER 'General case' 0 CA--C 1.504 -0.793 0 CA-C-O 121.913 0.863 . . . . 0.0 112.559 -179.294 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.81 ' HG3' ' C ' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -48.36 -44.19 34.24 Favored 'General case' 0 CA--C 1.49 -1.327 0 CA-C-N 113.845 -1.525 . . . . 0.0 107.134 177.014 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.749 ' HB3' ' OG1' ' A' ' 80' ' ' THR . 14.2 t -125.54 -178.61 4.3 Favored 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 112.849 -1.978 . . . . 0.0 109.407 179.647 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.625 ' CB ' ' CG ' ' A' ' 77' ' ' GLU . 3.0 p90 -162.27 160.51 26.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.281 0.562 . . . . 0.0 111.703 -179.491 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.943 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 43.9 t-20 -133.92 28.93 3.82 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 122.851 1.31 . . . . 0.0 107.696 177.501 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.55 ' O ' ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -6.14 130.3 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 111.616 -2.538 . . . . 0.0 112.551 -179.856 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 1.015 HG21 ' CG1' ' A' ' 25' ' ' ILE . 3.5 m -139.78 47.8 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.311 179.696 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.624 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 90.1 m -15.89 118.13 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.285 -179.016 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.957 HG12 ' CD1' ' A' ' 18' ' ' PHE . 3.0 m -120.28 -160.46 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.8 0 CA-C-O 121.726 0.774 . . . . 0.0 111.913 -179.867 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.629 ' HG3' ' CE2' ' A' ' 17' ' ' PHE . 29.0 mtp -13.04 131.61 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 113.874 -1.512 . . . . 0.0 112.854 -178.955 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 40.03 24.78 0.06 OUTLIER Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 115.458 -0.792 . . . . 0.0 113.214 179.059 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.536 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 84.91 36.98 10.58 Favored Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.872 179.724 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.725 ' HB2' ' CG2' ' A' ' 70' ' ' VAL . 1.2 m-30 -74.59 122.14 22.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.931 0.395 . . . . 0.0 110.822 179.923 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.18 109.62 22.28 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.784 -179.483 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.233 HG21 ' CG2' ' A' ' 25' ' ' ILE . 34.8 m -98.87 11.76 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.229 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.53 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.705 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER 25.27 42.32 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 -176.968 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.943 ' HB3' ' HB3' ' A' ' 66' ' ' ASN . 51.6 t30 -1.3 67.75 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 113.185 -1.825 . . . . 0.0 109.083 -174.466 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 1.005 ' N ' HD12 ' A' ' 26' ' ' LEU . 39.1 m170 -37.36 121.09 0.82 Allowed 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 112.928 -1.942 . . . . 0.0 113.781 -176.921 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.749 ' OG1' ' HB3' ' A' ' 64' ' ' SER . 2.2 p -104.47 -32.2 9.11 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 113.448 -1.706 . . . . 0.0 109.21 178.203 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.81 ' C ' ' HG3' ' A' ' 63' ' ' LYS . . . -143.15 136.06 27.83 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 177.795 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 1.2 m -124.25 134.74 53.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.902 0.382 . . . . 0.0 110.852 179.973 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.822 ' NE2' HG13 ' A' ' 61' ' ' VAL . 2.0 p80 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.384 -179.468 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.713 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 9.2 t . . . . . 0 CA--C 1.509 -0.618 0 CA-C-O 121.185 0.517 . . . . 0.0 110.821 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.929 HD23 HD13 ' A' ' 26' ' ' LEU . 2.4 mp -95.41 138.12 33.54 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.668 179.354 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.73 ' O ' ' O ' ' A' ' 14' ' ' GLU . 3.7 pt20 -123.0 69.23 0.99 Allowed 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 122.134 0.969 . . . . 0.0 111.749 178.831 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.73 ' O ' ' O ' ' A' ' 13' ' ' GLN . 28.0 tt0 14.78 123.57 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 112.704 -2.044 . . . . 0.0 112.255 179.998 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.934 HD22 HG11 ' A' ' 76' ' ' VAL . 33.2 t-20 -48.05 107.26 0.71 Allowed Pre-proline 0 C--N 1.306 -1.31 0 CA-C-N 113.527 -1.67 . . . . 0.0 112.072 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.732 ' HD2' ' CE1' ' A' ' 17' ' ' PHE . 72.8 Cg_endo -73.81 16.37 0.52 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.407 2.072 . . . . 0.0 112.958 179.7 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.732 ' CE1' ' HD2' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -126.24 -57.54 1.39 Allowed 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 121.787 0.804 . . . . 0.0 110.205 178.832 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.966 ' CD2' HG13 ' A' ' 70' ' ' VAL . 2.7 t80 -71.92 -19.19 61.96 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.219 -179.088 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.597 ' HB3' ' O ' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -48.76 87.61 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.546 -179.983 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.559 ' O ' ' N ' ' A' ' 22' ' ' GLY . 10.2 mm-40 -112.3 166.3 11.25 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.941 -179.65 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -61.85 60.83 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.752 2.301 . . . . 0.0 111.329 179.337 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.559 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 155.45 -14.24 0.45 Allowed Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.635 -179.611 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.452 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -142.97 108.87 5.44 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-O 121.784 0.802 . . . . 0.0 111.678 -179.492 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.634 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.8 Cg_endo -103.97 60.39 0.02 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.428 0 C-N-CA 124.613 3.542 . . . . 0.0 113.199 -178.556 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.31 ' CG2' HG21 ' A' ' 76' ' ' VAL . 31.6 mm -43.48 -174.07 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 CA-C-N 115.327 -0.852 . . . . 0.0 112.566 179.194 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.941 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -145.23 -168.27 2.9 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -175.011 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 172.4 96.01 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 111.482 -2.599 . . . . 0.0 109.99 179.2 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.713 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -40.51 112.49 0.29 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.83 -178.924 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.549 ' HB2' ' HG2' ' A' ' 13' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.227 0 C-N-CA 120.463 -0.495 . . . . 0.0 111.946 -179.874 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.857 ' O ' HG12 ' A' ' 61' ' ' VAL . 2.6 t . . . . . 0 C--O 1.23 0.065 0 CA-C-O 120.832 0.349 . . . . 0.0 110.377 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.702 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . -6.11 105.75 0.01 OUTLIER 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 122.065 0.936 . . . . 0.0 112.415 -179.916 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.792 ' HG3' ' CB ' ' A' ' 81' ' ' ALA . 0.1 OUTLIER -50.51 -43.53 55.77 Favored 'General case' 0 CA--C 1.495 -1.142 0 CA-C-N 113.733 -1.576 . . . . 0.0 108.397 177.802 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.607 ' CB ' ' OG1' ' A' ' 80' ' ' THR . 43.7 m -133.11 135.51 45.29 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 113.637 -1.619 . . . . 0.0 109.48 179.906 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.817 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -125.71 163.02 23.73 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.604 0.716 . . . . 0.0 112.436 -177.88 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.794 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -132.12 30.18 4.27 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 122.704 1.24 . . . . 0.0 107.9 177.388 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.54 ' CG ' ' HA ' ' A' ' 77' ' ' GLU . 0.2 OUTLIER -8.69 128.15 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 112.075 -2.329 . . . . 0.0 112.148 -179.786 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 1.047 HG21 HG13 ' A' ' 25' ' ' ILE . 4.6 m -134.84 49.52 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.454 179.915 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.661 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 55.2 m -23.2 118.62 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.196 -179.173 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.966 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -111.65 -167.39 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.726 0.774 . . . . 0.0 112.366 -179.603 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.521 ' C ' ' O ' ' A' ' 70' ' ' VAL . 1.2 mmm 16.62 -131.7 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.14 -1.391 . . . . 0.0 112.191 -179.937 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.81 -4.06 1.97 Allowed Glycine 0 N--CA 1.445 -0.74 0 CA-C-N 115.447 -0.797 . . . . 0.0 113.287 -179.63 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.587 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 130.22 28.68 0.7 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.137 -179.766 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.661 ' O ' ' HA ' ' A' ' 69' ' ' THR . 23.0 m-85 -66.13 120.42 13.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.831 0.348 . . . . 0.0 110.943 -179.644 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.506 ' HB3' ' HD3' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -99.79 115.56 29.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.804 -179.391 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 1.31 HG21 ' CG2' ' A' ' 25' ' ' ILE . 19.0 m -104.16 11.14 8.51 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.273 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.989 178.967 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.817 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 27.39 41.5 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 -177.172 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.915 ' HB2' HG13 ' A' ' 68' ' ' VAL . 50.3 t30 -1.23 68.09 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 113.729 -1.578 . . . . 0.0 109.149 -174.566 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.941 ' N ' HD12 ' A' ' 26' ' ' LEU . 41.8 m170 -38.59 120.19 0.91 Allowed 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 112.57 -2.105 . . . . 0.0 113.905 -176.743 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.607 ' OG1' ' CB ' ' A' ' 64' ' ' SER . 2.2 p -105.14 -34.88 7.79 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 113.503 -1.681 . . . . 0.0 109.557 178.542 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.792 ' CB ' ' HG3' ' A' ' 63' ' ' LYS . . . -140.89 140.04 34.48 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 177.625 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 82' ' ' CYS . . . . . 0.585 ' SG ' HD11 ' A' ' 12' ' ' LEU . 0.8 OUTLIER -128.09 133.71 49.06 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.59 -0.444 . . . . 0.0 111.818 -179.071 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.555 ' HB3' ' CD ' ' A' ' 63' ' ' LYS . 8.0 p80 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.673 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.437 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.806 0.336 . . . . 0.0 111.0 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 1' ' ' ALA . 1.7 Cg_endo -79.88 157.92 24.22 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.983 2.455 . . . . 0.0 112.079 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.413 ' OD1' ' C ' ' A' ' 2' ' ' PRO . 0.1 OUTLIER -165.58 -90.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.216 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.517 HG23 ' H ' ' A' ' 6' ' ' ASP . 34.9 m -119.85 -168.42 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.155 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -119.12 22.49 11.83 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.253 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.517 ' H ' HG23 ' A' ' 4' ' ' VAL . 4.5 m-20 60.37 -143.35 0.52 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.782 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.437 ' O ' ' O ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -139.71 95.34 8.86 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-O 120.832 0.349 . . . . 0.0 110.973 -179.888 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.515 ' O ' ' O ' ' A' ' 31' ' ' CYS . 46.5 Cg_exo -56.26 -135.27 0.0 OUTLIER 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.879 2.386 . . . . 0.0 112.298 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.596 ' HA ' ' O ' ' A' ' 31' ' ' CYS . 29.6 tt0 -122.46 157.53 31.76 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.838 0.352 . . . . 0.0 110.819 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.556 ' SG ' ' HA2' ' A' ' 30' ' ' GLY . 27.4 t -60.95 101.28 0.14 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.007 0.432 . . . . 0.0 111.074 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.754 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 7.1 t -126.29 -148.49 0.39 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.062 179.553 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.054 HD23 HD13 ' A' ' 26' ' ' LEU . 5.8 mp -111.25 134.72 52.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.753 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.752 ' HG3' ' HA ' ' A' ' 29' ' ' MET . 0.5 OUTLIER -98.26 51.29 1.02 Allowed 'General case' 0 CA--C 1.502 -0.868 0 CA-C-O 121.389 0.614 . . . . 0.0 111.766 -179.385 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.677 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 38.8 tt0 0.33 117.85 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 114.118 -1.401 . . . . 0.0 111.187 -179.575 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.814 ' OD1' HG11 ' A' ' 76' ' ' VAL . 0.2 OUTLIER -46.87 115.14 3.17 Favored Pre-proline 0 C--N 1.305 -1.367 0 CA-C-N 114.186 -1.37 . . . . 0.0 112.188 -179.267 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -80.35 16.44 1.54 Allowed 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.822 2.348 . . . . 0.0 111.262 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.458 ' H ' HD21 ' A' ' 15' ' ' ASN . 9.1 t80 -125.04 -55.06 1.6 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.886 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.962 ' CD2' HG13 ' A' ' 70' ' ' VAL . 0.4 OUTLIER -73.71 -16.17 61.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.588 179.966 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.603 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 17.1 p -52.98 79.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.524 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.598 ' N ' ' O ' ' A' ' 18' ' ' PHE . 3.3 pt20 -104.03 167.61 9.79 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.145 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -61.17 63.08 0.1 OUTLIER 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.682 2.255 . . . . 0.0 111.683 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.553 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 147.91 -8.65 1.12 Allowed Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.391 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.537 ' HB3' ' HG2' ' A' ' 20' ' ' GLN . . . -147.68 102.95 3.68 Favored Pre-proline 0 CA--C 1.513 -0.442 0 CA-C-O 122.071 0.939 . . . . 0.0 111.996 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.603 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 90.7 Cg_endo -104.14 65.32 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.51 0 C-N-CA 124.923 3.749 . . . . 0.0 112.795 -178.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.29 ' CG2' HG21 ' A' ' 76' ' ' VAL . 34.3 mm -42.23 -177.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.083 0 CA-C-N 115.198 -0.91 . . . . 0.0 113.444 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.054 HD13 HD23 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -148.23 -155.77 0.66 Allowed 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -174.719 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.565 ' NE2' ' O ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER 159.93 67.17 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 113.143 -1.844 . . . . 0.0 111.478 179.569 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.754 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.1 OUTLIER 4.8 118.33 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 114.992 -1.004 . . . . 0.0 113.425 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.752 ' HA ' ' HG3' ' A' ' 13' ' ' GLN . 3.9 ttt -58.92 -85.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.481 178.152 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.556 ' HA2' ' SG ' ' A' ' 10' ' ' CYS . . . 120.7 82.9 0.72 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.439 -0.886 . . . . 0.0 113.243 179.527 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.596 ' O ' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -168.83 47.62 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.835 0.35 . . . . 0.0 110.942 179.406 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.514 ' HA ' ' HG3' ' A' ' 9' ' ' GLU . 0.8 OUTLIER -73.54 55.04 0.48 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.886 179.87 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.624 ' CD1' ' N ' ' A' ' 33' ' ' PHE . 0.1 OUTLIER 50.26 -166.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.706 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 m -140.93 57.36 1.56 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.914 0.388 . . . . 0.0 110.832 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -65.69 142.19 58.11 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.86 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -128.24 83.2 2.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.187 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.675 ' CB ' ' HD3' ' A' ' 38' ' ' PRO . 11.6 m-85 -58.38 -72.87 0.22 Allowed Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.032 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.675 ' HD3' ' CB ' ' A' ' 37' ' ' TYR . 44.5 Cg_endo -86.61 -159.33 0.09 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.735 2.29 . . . . 0.0 111.503 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.425 ' HA ' ' HD2' ' A' ' 40' ' ' PRO . 23.2 m -78.56 117.74 68.23 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.425 ' HD2' ' HA ' ' A' ' 39' ' ' THR . 5.3 Cg_endo -48.43 125.36 12.16 Favored 'Trans proline' 0 N--CA 1.465 -0.196 0 C-N-CA 122.867 2.378 . . . . 0.0 112.393 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 39' ' ' THR . 0.0 OUTLIER -112.38 168.05 9.95 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.834 -179.902 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.533 ' O ' ' CB ' ' A' ' 43' ' ' SER . 0.0 OUTLIER -147.39 -166.61 2.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.416 -179.754 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 42' ' ' ARG . 8.0 t 87.36 79.97 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.776 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.425 ' O ' ' HB3' ' A' ' 45' ' ' LYS . 18.4 tptt -160.07 38.36 0.18 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.809 -179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.558 ' O ' ' HG3' ' A' ' 47' ' ' MET . 0.3 OUTLIER 78.82 -78.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.806 -179.93 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.594 HG23 HD23 ' A' ' 48' ' ' LEU . 37.3 m 20.48 -91.81 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.525 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.558 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 2.1 mtt 53.49 46.52 25.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.997 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.594 HD23 HG23 ' A' ' 46' ' ' THR . 0.3 OUTLIER -104.65 160.92 14.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.874 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.453 ' C ' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -35.16 107.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.523 179.668 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 57.0 mm-40 -69.68 56.82 0.13 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.321 -179.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -113.26 68.88 0.69 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.673 179.77 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.41 ' HB2' ' O ' ' A' ' 51' ' ' LYS . 76.6 m-20 66.32 39.55 4.02 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.678 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.414 ' HB ' HD11 ' A' ' 48' ' ' LEU . 2.1 t -141.63 25.11 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.049 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -124.47 -33.09 3.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.313 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.478 ' O ' ' O ' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -65.47 -53.82 37.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.347 -179.688 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.478 ' O ' ' O ' ' A' ' 55' ' ' SER . 0.3 OUTLIER -32.64 153.8 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.205 -179.855 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.581 ' OG ' ' N ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -135.53 -165.76 1.74 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.689 179.817 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.614 HG22 ' HA ' ' A' ' 85' ' ' SER . 1.9 p 55.87 175.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.964 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 10.1 m -155.08 138.06 15.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.004 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.593 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 0.1 OUTLIER -113.73 120.63 41.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.034 0.445 . . . . 0.0 111.211 -179.886 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.605 ' O ' ' C ' ' A' ' 62' ' ' ALA . 23.8 t -130.25 72.63 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.165 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.717 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 17.96 95.13 0.0 OUTLIER 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.889 -178.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.899 ' N ' ' O ' ' A' ' 81' ' ' ALA . 21.7 tttm -50.3 -32.84 18.04 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-O 121.648 0.737 . . . . 0.0 109.198 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.642 ' O ' ' N ' ' A' ' 80' ' ' THR . 12.7 m -147.37 105.14 3.71 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.039 179.197 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.817 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 2.9 p90 -91.04 164.63 13.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.486 0.66 . . . . 0.0 112.072 -179.041 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.707 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 3.5 t-20 -135.71 28.95 3.24 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 122.927 1.346 . . . . 0.0 107.823 177.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.516 ' CG ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -9.86 131.95 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 111.637 -2.529 . . . . 0.0 112.559 -179.48 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 1.058 HG21 ' CG1' ' A' ' 25' ' ' ILE . 14.0 m -139.36 52.24 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.323 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.686 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 50.7 m -24.62 118.3 0.05 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.564 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.962 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -115.92 -168.93 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.499 0.666 . . . . 0.0 112.316 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.568 ' SD ' ' CD2' ' A' ' 74' ' ' PHE . 1.1 mtp 30.44 -137.56 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.711 -1.131 . . . . 0.0 111.034 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -71.55 14.78 1.76 Allowed Glycine 0 N--CA 1.443 -0.833 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.624 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.552 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 123.92 36.78 0.61 Allowed Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.959 -0.639 . . . . 0.0 111.881 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.686 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.7 m-85 -75.16 118.3 17.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.961 0.41 . . . . 0.0 111.096 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.471 ' HB3' ' HD3' ' A' ' 67' ' ' ARG . 0.1 OUTLIER -98.71 124.12 43.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.478 0.656 . . . . 0.0 111.393 -179.526 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.29 HG21 ' CG2' ' A' ' 25' ' ' ILE . 27.1 m -117.69 11.67 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.308 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.201 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.817 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.4 OUTLIER 25.81 40.54 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 -177.124 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.73 ' N ' ' O ' ' A' ' 76' ' ' VAL . 33.6 t30 -2.97 69.53 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 113.528 -1.669 . . . . 0.0 109.26 -174.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.996 ' N ' HD12 ' A' ' 26' ' ' LEU . 40.5 m170 -39.54 120.02 1.03 Allowed 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 113.068 -1.878 . . . . 0.0 113.266 -177.266 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.642 ' N ' ' O ' ' A' ' 64' ' ' SER . 0.6 OUTLIER -112.52 -5.65 14.02 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 113.425 -1.716 . . . . 0.0 110.325 179.606 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.899 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -171.38 83.9 0.08 Allowed 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.278 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.57 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 1.2 m -80.52 127.99 33.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.73 0.3 . . . . 0.0 110.943 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.593 ' O ' ' HA ' ' A' ' 60' ' ' CYS . 22.3 p-80 -125.76 108.62 11.68 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.322 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.553 ' O ' ' CB ' ' A' ' 85' ' ' SER . 29.3 p -86.7 104.81 16.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.934 0.397 . . . . 0.0 110.602 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.614 ' HA ' HG22 ' A' ' 58' ' ' THR . 14.4 t 153.54 -160.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.144 -179.656 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.574 ' N ' ' OG ' ' A' ' 85' ' ' SER . 0.2 OUTLIER 34.26 56.19 0.64 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.974 0.416 . . . . 0.0 110.482 179.901 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 3.0 t -80.63 16.31 1.42 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.369 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -174.43 -166.55 0.27 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.843 0.354 . . . . 0.0 110.88 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -126.08 151.04 47.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.017 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.477 ' O ' ' N ' ' A' ' 92' ' ' SER . 0.0 OUTLIER -110.99 -173.94 2.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.42 179.568 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.602 ' O ' ' C ' ' A' ' 92' ' ' SER . 1.0 OUTLIER 51.75 -89.04 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.505 -179.668 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.602 ' C ' ' O ' ' A' ' 91' ' ' LYS . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.294 -0.86 . . . . 0.0 111.728 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 0.996 ' H82' HD11 ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 183' ' ' NAG . . . . . 0.77 ' H3 ' ' H2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.652 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 185' ' ' GAL . . . . . 0.652 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 186' ' ' GAL . . . . . 0.77 ' H2 ' ' H3 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.844 0.354 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -47.38 166.33 0.1 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.274 0 C-N-CA 122.804 2.336 . . . . 0.0 112.447 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -101.89 178.04 4.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.696 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 70.9 t -77.6 144.81 10.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.238 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -95.01 -170.09 2.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.851 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -91.09 152.57 20.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.986 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.561 ' CB ' ' HD2' ' A' ' 8' ' ' PRO . 0.4 OUTLIER -177.47 176.23 0.51 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.754 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.561 ' HD2' ' CB ' ' A' ' 7' ' ' CYS . 83.0 Cg_exo -35.72 140.13 0.13 Allowed 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.847 2.365 . . . . 0.0 112.619 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.553 ' O ' HG22 ' A' ' 11' ' ' THR . 5.2 tt0 -48.87 106.89 0.11 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.978 -179.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.526 ' CB ' ' N ' ' A' ' 32' ' ' CYS . 0.3 OUTLIER -44.09 127.32 5.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.226 -179.868 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.706 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 10.0 t 177.47 -170.63 0.09 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.495 179.435 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.912 HD23 HD13 ' A' ' 26' ' ' LEU . 6.5 mp -81.22 135.37 35.74 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.0 -179.294 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.652 ' O ' ' O ' ' A' ' 14' ' ' GLU . 54.6 mt-30 -118.33 57.53 0.85 Allowed 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.365 179.403 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.652 ' O ' ' O ' ' A' ' 13' ' ' GLN . 6.1 tt0 7.69 119.87 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.813 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.931 ' ND2' HG11 ' A' ' 76' ' ' VAL . 3.5 t-20 -39.22 128.03 1.3 Allowed Pre-proline 0 C--N 1.309 -1.167 0 CA-C-N 114.337 -1.302 . . . . 0.0 111.837 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.486 ' HD2' ' OD1' ' A' ' 15' ' ' ASN . 94.2 Cg_endo -85.22 31.95 0.48 Allowed 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.65 2.233 . . . . 0.0 111.167 178.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.521 ' CE2' ' HG3' ' A' ' 71' ' ' MET . 22.4 t80 -148.41 -55.75 0.21 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.634 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.869 ' CE2' HG13 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -70.76 -26.0 63.16 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.825 -1.079 . . . . 0.0 110.834 -179.51 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.675 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 35.9 t -50.92 81.09 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.944 -179.504 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.584 ' N ' ' O ' ' A' ' 18' ' ' PHE . 3.9 mm-40 -122.55 159.01 54.75 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.068 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -51.02 77.52 0.02 OUTLIER 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.748 2.299 . . . . 0.0 111.876 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 138.61 -18.63 3.21 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.601 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.565 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -147.11 102.76 3.82 Favored Pre-proline 0 CA--C 1.513 -0.475 0 CA-C-O 121.871 0.843 . . . . 0.0 111.782 -179.617 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.675 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 93.5 Cg_endo -105.89 64.49 0.02 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.564 0 C-N-CA 124.671 3.58 . . . . 0.0 113.603 -178.232 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.233 ' CG2' HG21 ' A' ' 76' ' ' VAL . 24.5 mm -43.4 -174.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.051 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.691 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.143 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -151.37 -161.67 1.38 Allowed 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 114.49 1.292 . . . . 0.0 114.49 -175.418 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.493 ' CB ' ' O ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER 159.72 83.51 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 112.809 -1.996 . . . . 0.0 110.9 179.104 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.706 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.0 OUTLIER -27.57 110.5 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.004 -179.405 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.589 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.7 mmt -127.59 107.11 9.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.902 0.382 . . . . 0.0 111.161 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.471 ' HA3' ' HA ' ' A' ' 10' ' ' CYS . . . 161.62 -158.88 30.76 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.999 -0.619 . . . . 0.0 112.385 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.415 ' SG ' ' C ' ' A' ' 30' ' ' GLY . 1.8 m -155.23 101.38 2.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.649 0.261 . . . . 0.0 110.871 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.526 ' N ' ' CB ' ' A' ' 10' ' ' CYS . 0.8 OUTLIER -54.12 169.54 0.17 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.571 179.939 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.527 ' CD1' ' N ' ' A' ' 33' ' ' PHE . 0.5 OUTLIER -160.15 160.87 33.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.087 -179.912 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 m -53.89 -30.46 46.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.142 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.5 mtp85 67.4 98.77 0.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.272 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -179.6 25.68 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.484 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.577 ' N ' ' CD ' ' A' ' 38' ' ' PRO . 0.3 OUTLIER -130.43 43.76 1.2 Allowed Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 120.813 0.339 . . . . 0.0 111.264 -179.845 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 37' ' ' TYR . 57.1 Cg_endo -71.1 -166.6 0.24 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.672 2.248 . . . . 0.0 112.23 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.3 t -104.36 83.8 0.8 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.321 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.95 -160.63 0.04 OUTLIER 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.739 2.293 . . . . 0.0 112.11 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.669 ' O ' ' CB ' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -76.47 -3.21 36.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.953 -179.927 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.669 ' CB ' ' O ' ' A' ' 41' ' ' LEU . 4.8 tmm_? 135.0 -50.8 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.314 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 55.0 m -45.93 115.01 0.88 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.11 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -115.89 163.98 15.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.408 179.602 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.48 48.83 19.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.967 0.413 . . . . 0.0 110.606 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.529 ' O ' ' CB ' ' A' ' 47' ' ' MET . 11.2 m -166.77 136.42 3.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.759 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.529 ' CB ' ' O ' ' A' ' 46' ' ' THR . 4.7 mtt 157.97 61.33 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.809 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.457 ' O ' ' O ' ' A' ' 47' ' ' MET . 4.4 tp 55.92 154.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.993 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.45 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -78.77 -163.06 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.108 179.951 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.443 ' H ' HG12 ' A' ' 49' ' ' VAL . 5.8 mt-30 53.5 42.27 31.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.133 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.436 ' HD2' ' HA ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -118.6 50.99 1.13 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.815 0.34 . . . . 0.0 111.187 -179.946 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.457 ' O ' ' C ' ' A' ' 53' ' ' VAL . 28.3 t-20 -152.1 50.75 0.79 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.034 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.457 ' C ' ' O ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -33.41 147.31 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.782 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 55' ' ' SER . 6.6 m -149.31 131.18 15.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.889 0.376 . . . . 0.0 111.176 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.493 ' O ' ' HB3' ' A' ' 56' ' ' GLU . 8.4 t 176.95 -36.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.709 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.493 ' HB3' ' O ' ' A' ' 55' ' ' SER . 0.0 OUTLIER 170.56 124.82 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.837 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.86 172.85 0.23 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.901 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.445 HG22 ' C ' ' A' ' 84' ' ' CYS . 0.0 OUTLIER -112.3 158.46 19.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.197 -179.797 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.583 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 0.5 OUTLIER -163.11 123.58 2.31 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.888 179.758 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.662 ' O ' ' HB ' ' A' ' 61' ' ' VAL . 1.7 m -55.3 -177.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.805 -179.303 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.662 ' HB ' ' O ' ' A' ' 60' ' ' CYS . 9.6 p 148.28 62.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.604 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.588 ' HA ' ' HA ' ' A' ' 82' ' ' CYS . . . 10.28 110.02 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.511 -179.526 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.884 ' N ' ' O ' ' A' ' 81' ' ' ALA . 8.2 ttmt -57.01 -42.96 81.3 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.611 0.72 . . . . 0.0 109.088 178.229 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.523 ' O ' ' N ' ' A' ' 80' ' ' THR . 16.9 m -141.03 128.75 21.57 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.523 -1.217 . . . . 0.0 109.095 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.748 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 4.8 p90 -114.73 157.52 23.07 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -178.157 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.945 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -125.3 27.97 6.45 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 122.615 1.198 . . . . 0.0 108.219 176.645 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.7 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 4.2 ptp180 -8.35 103.72 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 112.36 -2.2 . . . . 0.0 111.966 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 1.018 HG21 HG13 ' A' ' 25' ' ' ILE . 3.4 m -104.02 45.93 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.393 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.675 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 28.5 m -16.33 119.05 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.63 -178.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.869 HG13 ' CE2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -113.49 -162.8 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.691 179.94 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.521 ' HG3' ' CE2' ' A' ' 17' ' ' PHE . 6.0 mtp -29.13 151.58 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.208 -1.36 . . . . 0.0 111.907 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 43.7 23.87 0.39 Allowed Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.645 -0.788 . . . . 0.0 111.966 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.463 ' C ' HG23 ' A' ' 69' ' ' THR . . . 73.77 28.84 64.25 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.163 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.708 ' CB ' HG23 ' A' ' 70' ' ' VAL . 20.3 m-85 -43.81 170.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.65 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 22.3 mtmt -153.72 93.26 1.65 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.859 0.361 . . . . 0.0 111.318 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.233 HG21 ' CG2' ' A' ' 25' ' ' ILE . 18.6 m -93.0 15.73 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.489 -1.391 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.764 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.748 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 23.42 43.72 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 -177.691 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.945 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 12.9 t-20 1.55 75.52 0.0 OUTLIER 'General case' 0 CA--C 1.499 -1.005 0 CA-C-N 114.519 -1.219 . . . . 0.0 108.043 -175.02 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 1.143 ' N ' HD12 ' A' ' 26' ' ' LEU . 33.6 m170 -49.19 99.58 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.419 0 CA-C-O 122.61 1.195 . . . . 0.0 111.669 -176.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.711 HG23 ' O ' ' A' ' 78' ' ' ASN . 2.8 p -92.07 -3.5 55.66 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.55 -1.659 . . . . 0.0 109.71 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.884 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -174.33 126.75 0.34 Allowed 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.5 OUTLIER -121.47 127.91 51.56 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.987 0.422 . . . . 0.0 111.281 -179.21 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -140.77 137.52 33.44 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.788 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.583 ' HA ' ' O ' ' A' ' 59' ' ' CYS . 78.2 m -91.85 137.04 32.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.851 0.358 . . . . 0.0 110.96 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.456 ' N ' ' H ' ' A' ' 59' ' ' CYS . 6.7 p -148.74 -151.88 0.41 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.834 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.51 ' HB ' ' CE1' ' A' ' 89' ' ' TYR . 5.3 m -91.06 23.71 3.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.848 0.356 . . . . 0.0 110.994 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.479 ' O ' ' O ' ' A' ' 88' ' ' TYR . 33.7 m 58.74 82.08 0.15 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.356 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.479 ' O ' ' O ' ' A' ' 87' ' ' CYS . 0.8 OUTLIER 28.96 97.21 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.479 179.439 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.51 ' CE1' ' HB ' ' A' ' 86' ' ' THR . 13.0 m-85 -52.2 -58.14 7.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.791 179.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.476 ' O ' ' O ' ' A' ' 89' ' ' TYR . 0.4 OUTLIER 39.78 -167.41 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.94 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.502 ' O ' ' CG ' ' A' ' 91' ' ' LYS . 12.8 tttm -114.25 58.68 0.69 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.946 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.0 p . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.966 180.0 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 0.731 ' H82' HD11 ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 180' ' ' BMA . . . . . 0.473 ' H2 ' ' O5 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 181' ' ' MAN . . . . . 0.473 ' O5 ' ' H2 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 182' ' ' MAN . . . . . 0.442 ' H2 ' ' H61' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 183' ' ' NAG . . . . . 0.537 ' O3 ' ' O5 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.514 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 185' ' ' GAL . . . . . 0.514 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 186' ' ' GAL . . . . . 0.537 ' O5 ' ' O3 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.586 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.484 1.268 0 CA-C-O 120.69 0.281 . . . . 0.0 111.22 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.586 ' HD2' ' N ' ' A' ' 1' ' ' ALA . 35.6 Cg_endo -66.07 -170.38 0.19 Allowed 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.379 2.052 . . . . 0.0 112.296 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.4 ' OD1' ' O ' ' A' ' 3' ' ' ASP . 0.7 OUTLIER -102.55 148.62 25.31 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.922 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -139.05 19.45 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.891 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.463 ' O ' ' HB2' ' A' ' 6' ' ' ASP . 4.4 mt-30 -155.26 -165.38 1.99 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.731 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.463 ' HB2' ' O ' ' A' ' 5' ' ' GLN . 0.5 OUTLIER 71.6 136.9 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.591 -179.81 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -45.26 161.82 0.23 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.736 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -82.31 23.38 0.79 Allowed 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.868 2.379 . . . . 0.0 112.56 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 71.97 148.96 0.09 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.955 0.407 . . . . 0.0 110.941 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.501 ' N ' ' O ' ' A' ' 31' ' ' CYS . 3.4 t -85.33 130.15 34.66 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.681 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.709 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 4.8 t -177.94 -171.32 0.28 Allowed 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.159 0.504 . . . . 0.0 111.021 179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.864 HD23 HD13 ' A' ' 26' ' ' LEU . 8.2 mp -75.28 126.34 30.81 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.925 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.586 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.9 mt-30 -104.16 52.81 0.75 Allowed 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.948 179.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.645 ' HG3' ' HB2' ' A' ' 24' ' ' PRO . 2.1 tt0 -1.16 121.87 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.159 -1.837 . . . . 0.0 111.401 -178.773 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.735 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.4 OUTLIER -58.68 102.06 0.28 Allowed Pre-proline 0 C--N 1.307 -1.247 0 CA-C-N 114.348 -1.296 . . . . 0.0 112.565 -179.101 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.522 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 2.8 Cg_exo -73.45 2.37 5.8 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.267 1.978 . . . . 0.0 109.084 177.321 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.527 ' CE1' ' SD ' ' A' ' 71' ' ' MET . 2.1 t80 -93.3 -60.69 1.73 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 113.557 -1.656 . . . . 0.0 110.287 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.866 ' CD1' HG21 ' A' ' 70' ' ' VAL . 12.6 m-85 -81.35 -5.79 58.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.044 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.512 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -52.81 89.15 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.51 179.72 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.553 ' CB ' ' CD ' ' A' ' 21' ' ' PRO . 5.3 pt20 -96.55 -176.38 0.53 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.818 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.553 ' CD ' ' CB ' ' A' ' 20' ' ' GLN . 2.9 Cg_endo -73.86 60.63 4.51 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.522 2.148 . . . . 0.0 111.402 179.422 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 143.12 3.35 0.9 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.661 -0.78 . . . . 0.0 113.263 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.952 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -154.56 105.82 2.36 Favored Pre-proline 0 CA--C 1.514 -0.405 0 CA-C-O 121.894 0.854 . . . . 0.0 111.808 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.661 ' O ' ' O ' ' A' ' 25' ' ' ILE . 66.6 Cg_endo -103.4 73.08 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.392 0 C-N-CA 124.77 3.647 . . . . 0.0 113.004 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.162 ' CG2' HG21 ' A' ' 76' ' ' VAL . 6.7 mm -38.52 -177.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.885 ' N ' HG22 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -151.21 -163.66 1.82 Allowed 'General case' 0 CA--C 1.499 -1.013 0 CA-C-O 122.851 1.31 . . . . 0.0 114.262 -175.981 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.558 ' O ' ' CG ' ' A' ' 27' ' ' GLN . 0.3 OUTLIER 166.27 66.49 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 112.363 -2.198 . . . . 0.0 110.836 179.331 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.709 ' HA ' ' O ' ' A' ' 11' ' ' THR . 3.9 t -24.73 109.26 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.223 -179.545 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.52 ' HG2' ' OE1' ' A' ' 13' ' ' GLN . 3.4 ttm -147.46 125.91 12.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.078 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 169.29 -135.65 3.69 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.854 -0.688 . . . . 0.0 112.158 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.501 ' O ' ' N ' ' A' ' 10' ' ' CYS . 2.8 m -146.69 140.15 25.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.724 0.297 . . . . 0.0 110.675 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.7 p -106.76 138.38 43.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.934 0.397 . . . . 0.0 111.259 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.561 ' CD1' ' N ' ' A' ' 34' ' ' SER . 4.4 p90 -161.81 -31.87 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.688 179.623 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.561 ' N ' ' CD1' ' A' ' 33' ' ' PHE . 3.4 m -61.5 137.44 58.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.487 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.697 ' O ' ' HB2' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 66.49 111.66 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.782 -179.808 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.697 ' HB2' ' O ' ' A' ' 35' ' ' ARG . . . 159.64 97.41 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.383 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.438 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.5 OUTLIER -45.85 155.11 0.52 Allowed Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.191 179.608 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.438 ' C ' ' O ' ' A' ' 37' ' ' TYR . 66.8 Cg_exo -29.74 143.52 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 123.023 2.482 . . . . 0.0 112.295 179.893 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.9 t -112.71 130.9 23.0 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.054 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -69.76 149.79 67.37 Favored 'Trans proline' 0 C--O 1.231 0.133 0 C-N-CA 122.981 2.454 . . . . 0.0 112.391 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.622 HD23 ' HB2' ' A' ' 42' ' ' ARG . 2.3 tt -95.15 -9.38 33.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.688 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.622 ' HB2' HD23 ' A' ' 41' ' ' LEU . 5.8 mtp180 166.82 133.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.127 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 30.0 m -153.89 19.83 0.52 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.612 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.26 166.04 13.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.826 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -166.86 -164.52 0.64 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.002 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -97.96 38.34 1.32 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.024 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.7 ttp -130.88 -81.61 0.53 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.917 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.523 ' HB3' ' CE ' ' A' ' 51' ' ' LYS . 0.2 OUTLIER -89.04 110.54 21.23 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.817 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.463 ' O ' ' O ' ' A' ' 48' ' ' LEU . 2.4 m -44.17 174.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.378 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.543 ' CG ' ' HB ' ' A' ' 53' ' ' VAL . 0.1 OUTLIER -33.84 118.45 0.36 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.397 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.525 ' O ' ' CB ' ' A' ' 52' ' ' ASN . 18.0 ptpt -122.73 74.44 1.2 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.409 179.617 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.525 ' CB ' ' O ' ' A' ' 51' ' ' LYS . 18.5 t30 86.58 50.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.352 -179.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.543 ' HB ' ' CG ' ' A' ' 50' ' ' GLN . 2.1 p -57.34 140.61 15.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.662 -179.484 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.1 p -131.81 -26.21 2.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.642 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 m -74.08 58.52 0.69 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.81 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.428 ' OE2' ' OG ' ' A' ' 85' ' ' SER . 0.1 OUTLIER -100.36 134.79 42.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.505 179.747 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -46.92 93.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.907 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.422 ' N ' ' O ' ' A' ' 56' ' ' GLU . 0.5 OUTLIER -66.56 140.57 57.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.042 0.448 . . . . 0.0 111.002 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.494 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 0.5 OUTLIER -157.65 138.78 13.44 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.21 179.83 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -105.8 71.62 0.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.786 179.766 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.661 ' O ' HG12 ' A' ' 61' ' ' VAL . 40.1 t -88.49 79.33 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.979 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.692 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 16.83 112.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.634 ' N ' ' O ' ' A' ' 81' ' ' ALA . 20.2 ttmt -54.16 -33.61 58.41 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.652 ' O ' ' HB1' ' A' ' 62' ' ' ALA . 1.8 m -137.27 -175.32 4.02 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.964 178.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.69 ' HB3' ' HB3' ' A' ' 77' ' ' GLU . 1.0 OUTLIER -164.6 162.06 21.34 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.288 0.566 . . . . 0.0 111.588 -179.77 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.674 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -132.54 27.66 4.36 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.194 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.6 ' HG3' ' HA ' ' A' ' 77' ' ' GLU . 2.4 ttm105 -8.05 121.4 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 112.284 -2.235 . . . . 0.0 111.311 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 1.069 HG13 ' HB2' ' A' ' 78' ' ' ASN . 4.3 m -123.72 43.62 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.803 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.653 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 54.5 m -17.82 118.35 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.764 -178.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.866 HG21 ' CD1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -122.25 -169.79 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.485 -179.054 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.632 ' HG3' ' CG ' ' A' ' 74' ' ' PHE . 0.1 OUTLIER 41.54 -140.09 0.12 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.368 -179.59 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -70.63 0.34 27.68 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.811 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.431 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 136.11 40.94 0.13 Allowed Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.525 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.675 ' C ' ' HG2' ' A' ' 75' ' ' LYS . 2.4 m-85 -69.41 -179.33 1.62 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.675 ' HG2' ' C ' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -157.45 97.58 1.62 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.984 0.365 . . . . 0.0 111.984 -179.466 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.162 HG21 ' CG2' ' A' ' 25' ' ' ILE . 16.3 m -91.62 11.93 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.42 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.013 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.755 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 29.22 39.56 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 105.083 -2.192 . . . . 0.0 105.083 -176.601 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 1.069 ' HB2' HG13 ' A' ' 68' ' ' VAL . 32.7 t30 -0.14 65.45 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 112.816 -1.993 . . . . 0.0 108.378 -174.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.881 ' O ' HD13 ' A' ' 26' ' ' LEU . 37.8 m170 -34.46 123.58 0.52 Allowed 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 112.703 -2.044 . . . . 0.0 113.43 -176.711 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.492 ' OG1' ' HB3' ' A' ' 64' ' ' SER . 6.5 p -110.78 -15.14 13.88 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 113.471 -1.695 . . . . 0.0 110.426 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.634 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -161.87 147.65 13.47 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.888 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.5 OUTLIER -127.27 154.55 44.75 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.904 0.383 . . . . 0.0 111.227 -179.98 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.434 ' O ' ' HA ' ' A' ' 60' ' ' CYS . 0.0 OUTLIER -155.66 112.86 3.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.943 -179.931 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.705 ' O ' ' CB ' ' A' ' 85' ' ' SER . 4.1 t -88.4 123.79 33.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.122 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.705 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 36.9 t 119.12 43.05 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.155 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 66.7 p -147.55 68.32 1.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.763 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 1.8 m -156.97 83.6 0.94 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.837 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.412 ' CD1' ' C ' ' A' ' 88' ' ' TYR . 8.1 p90 -92.52 141.42 28.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.905 0.383 . . . . 0.0 111.007 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.513 ' O ' ' C ' ' A' ' 90' ' ' HIS . 0.2 OUTLIER -168.2 172.67 8.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.669 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.513 ' C ' ' O ' ' A' ' 89' ' ' TYR . 23.1 m170 26.04 72.7 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.228 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.439 ' O ' ' HG3' ' A' ' 91' ' ' LYS . 0.0 OUTLIER -110.13 4.98 21.64 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.296 -179.653 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 85.4 p . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.297 -0.858 . . . . 0.0 110.932 -179.746 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 0.952 ' H83' ' HB1' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.56 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 180' ' ' BMA . . . . . 0.485 ' H3 ' ' H2 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 181' ' ' MAN . . . . . 0.557 ' O2 ' ' O7 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.557 ' O7 ' ' O2 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 185' ' ' GAL . . . . . 0.503 ' H2 ' ' O3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.771 0.319 . . . . 0.0 111.014 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.478 ' O ' ' HB3' ' A' ' 3' ' ' ASP . 45.8 Cg_exo -55.76 -164.59 0.01 OUTLIER 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.708 2.272 . . . . 0.0 112.466 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.478 ' HB3' ' O ' ' A' ' 2' ' ' PRO . 6.8 p-10 167.94 -26.83 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.687 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.534 HG22 ' HG2' ' A' ' 5' ' ' GLN . 1.5 p -32.35 119.07 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.464 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.534 ' HG2' HG22 ' A' ' 4' ' ' VAL . 7.7 pt20 23.51 60.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.508 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' ' 4' ' ' VAL . 1.0 OUTLIER -159.45 121.1 3.32 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.838 179.91 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.448 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 31.1 p -136.05 143.65 44.95 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.955 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 7' ' ' CYS . 28.4 Cg_exo -60.79 130.46 33.16 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.68 2.253 . . . . 0.0 111.968 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.428 ' C ' ' O ' ' A' ' 8' ' ' PRO . 9.7 tt0 -35.87 129.33 0.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.031 0.443 . . . . 0.0 110.949 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.474 ' HB3' ' SG ' ' A' ' 32' ' ' CYS . 42.6 t -41.07 134.76 1.96 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.349 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.689 ' O ' ' N ' ' A' ' 29' ' ' MET . 3.3 t -173.61 -169.68 0.53 Allowed 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.37 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.853 HD23 HD13 ' A' ' 26' ' ' LEU . 7.8 mp -75.74 133.66 40.68 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.274 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.713 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.7 mt-30 -120.75 65.12 0.85 Allowed 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 121.636 0.731 . . . . 0.0 110.977 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.713 ' O ' ' O ' ' A' ' 13' ' ' GLN . 18.2 tt0 2.91 127.22 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 113.566 -1.652 . . . . 0.0 111.903 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.884 ' ND2' ' CZ ' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -56.19 108.82 1.32 Allowed Pre-proline 0 C--N 1.307 -1.28 0 CA-C-N 113.858 -1.519 . . . . 0.0 113.339 -178.949 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.755 ' HD2' ' CE1' ' A' ' 17' ' ' PHE . 9.9 Cg_exo -69.95 4.95 1.97 Allowed 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.508 2.139 . . . . 0.0 112.042 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.884 ' CZ ' ' ND2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -114.12 -56.16 2.42 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.394 178.674 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 1.187 ' CD2' HG13 ' A' ' 70' ' ' VAL . 0.3 OUTLIER -78.97 -5.58 54.18 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.888 -178.751 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.468 ' CB ' ' O ' ' A' ' 15' ' ' ASN . 2.2 t -64.91 95.28 0.15 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.746 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.575 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.1 OUTLIER -135.84 144.74 49.92 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.857 -179.649 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.563 ' CD ' ' HG3' ' A' ' 20' ' ' GLN . 1.3 Cg_endo -45.1 82.91 0.01 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.7 2.267 . . . . 0.0 111.343 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.575 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 138.35 -15.87 3.41 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.73 -179.088 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.444 ' O ' ' O ' ' A' ' 18' ' ' PHE . . . -153.95 100.28 2.53 Favored Pre-proline 0 CA--C 1.51 -0.587 0 CA-C-O 121.958 0.885 . . . . 0.0 111.094 179.731 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.662 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.1 Cg_endo -103.26 60.33 0.02 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.588 0 C-N-CA 124.643 3.562 . . . . 0.0 112.78 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.226 ' CG2' HG21 ' A' ' 76' ' ' VAL . 23.1 mm -40.25 -176.69 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.141 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.876 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.994 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -148.87 -160.16 1.13 Allowed 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -175.105 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.466 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER 161.8 98.17 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 112.376 -2.193 . . . . 0.0 109.723 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.649 ' SG ' HD12 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -48.29 103.65 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.492 -0.777 . . . . 0.0 111.711 -178.531 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.689 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.0 OUTLIER -114.6 -165.21 0.99 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.47 179.512 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.11 -145.15 17.99 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.599 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -154.82 147.06 23.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.827 0.346 . . . . 0.0 110.896 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.474 ' SG ' ' HB3' ' A' ' 10' ' ' CYS . 4.1 m -100.21 -174.79 2.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.896 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -141.76 -56.96 0.47 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.782 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.445 ' OG ' ' N ' ' A' ' 35' ' ' ARG . 24.4 p -166.6 -132.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.594 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.445 ' N ' ' OG ' ' A' ' 34' ' ' SER . 4.4 ttt180 -166.12 100.88 0.64 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.842 0.353 . . . . 0.0 110.957 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.485 ' O ' ' C ' ' A' ' 37' ' ' TYR . . . 56.24 158.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.453 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.485 ' C ' ' O ' ' A' ' 36' ' ' ALA . 3.0 m-30 28.58 74.76 0.38 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.238 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.437 ' O ' ' O ' ' A' ' 39' ' ' THR . 30.6 Cg_endo -65.07 -3.77 7.79 Favored 'Trans proline' 0 CA--C 1.515 -0.433 0 C-N-CA 122.826 2.35 . . . . 0.0 112.513 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.437 ' O ' ' O ' ' A' ' 38' ' ' PRO . 69.0 p 45.63 100.5 0.03 OUTLIER Pre-proline 0 C--N 1.313 -1.003 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.702 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.492 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 36.2 Cg_exo -61.36 -165.23 0.04 OUTLIER 'Trans proline' 0 C--O 1.231 0.131 0 C-N-CA 122.854 2.369 . . . . 0.0 111.78 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.492 ' HB2' ' O ' ' A' ' 40' ' ' PRO . 26.1 mt 66.56 142.8 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.888 0.375 . . . . 0.0 110.899 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -118.45 68.91 0.79 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.817 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 88.4 p -108.86 49.49 0.81 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.067 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.88 98.24 6.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.643 179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.42 92.59 7.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.168 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.445 ' C ' ' CG ' ' A' ' 47' ' ' MET . 1.3 t -56.41 171.17 0.31 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.906 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.445 ' CG ' ' C ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -163.76 34.47 0.08 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.871 179.886 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.647 ' HG ' HG23 ' A' ' 49' ' ' VAL . 34.4 tp -146.37 101.31 3.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.005 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.647 HG23 ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER 53.53 116.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.108 -179.907 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -97.06 37.04 1.35 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.089 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -121.21 29.05 7.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.826 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.486 ' O ' ' O ' ' A' ' 53' ' ' VAL . 3.8 m-20 81.28 89.2 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.897 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.486 ' O ' ' O ' ' A' ' 52' ' ' ASN . 2.8 m -49.38 -171.57 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.195 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.411 ' N ' HG23 ' A' ' 53' ' ' VAL . 23.2 p -80.06 -153.47 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.918 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.9 m -112.74 111.82 22.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.868 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.46 69.63 1.2 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.941 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.9 p -149.73 -98.0 0.07 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.131 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.513 HG22 ' HB2' ' A' ' 85' ' ' SER . 1.1 p -106.68 -173.16 2.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.956 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.558 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 0.7 OUTLIER 170.44 112.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.347 179.535 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.469 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 0.1 OUTLIER -77.88 115.48 17.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.964 179.827 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.624 ' O ' ' C ' ' A' ' 62' ' ' ALA . 47.8 t -133.51 71.93 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.713 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.624 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 0.3 103.36 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.696 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.791 ' N ' ' O ' ' A' ' 81' ' ' ALA . 1.6 ttmm -54.84 -38.74 67.81 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.545 ' O ' ' N ' ' A' ' 80' ' ' THR . 15.5 m -140.94 117.0 10.52 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.779 -1.101 . . . . 0.0 109.717 178.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.752 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 2.8 p90 -107.57 161.99 14.36 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.283 -178.469 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.82 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 1.0 OUTLIER -129.69 28.13 5.16 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 122.357 1.075 . . . . 0.0 108.173 177.11 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.744 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -11.85 115.81 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 112.565 -2.107 . . . . 0.0 111.734 -179.899 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 1.044 HG21 HG13 ' A' ' 25' ' ' ILE . 3.8 m -120.14 48.12 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 114.867 -1.06 . . . . 0.0 110.737 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.637 ' C ' ' O ' ' A' ' 68' ' ' VAL . 5.8 m -14.05 118.84 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.079 -179.062 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 1.187 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -107.52 -162.42 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.799 0.809 . . . . 0.0 111.729 -179.8 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.539 ' O ' ' CD1' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -32.66 151.45 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.929 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 48.01 19.23 0.95 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.15 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.58 ' C ' HG23 ' A' ' 69' ' ' THR . . . 70.82 30.26 68.41 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.303 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.587 ' O ' ' HA ' ' A' ' 69' ' ' THR . 5.8 m-30 -51.67 -174.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.803 0.335 . . . . 0.0 111.007 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -158.97 121.05 3.49 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.274 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.226 HG21 ' CG2' ' A' ' 25' ' ' ILE . 19.6 m -118.18 12.08 7.11 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.494 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.437 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.752 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 28.26 39.71 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 -177.05 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.919 ' HB2' HG13 ' A' ' 68' ' ' VAL . 49.2 t30 -0.8 68.49 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.899 0 CA-C-N 113.531 -1.668 . . . . 0.0 108.55 -174.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.994 ' N ' HD12 ' A' ' 26' ' ' LEU . 39.4 m170 -39.48 118.01 0.78 Allowed 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 113.198 -1.819 . . . . 0.0 114.1 -176.442 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.545 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.0 OUTLIER -109.12 -17.01 13.98 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 113.379 -1.737 . . . . 0.0 109.487 178.792 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.791 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -162.88 136.93 6.19 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.263 -0.88 . . . . 0.0 108.942 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -125.9 140.98 52.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.706 0.289 . . . . 0.0 110.636 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.787 ' NE2' HG21 ' A' ' 86' ' ' THR . 2.6 p-80 -136.6 114.43 11.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.98 0.419 . . . . 0.0 111.502 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.628 ' O ' ' CB ' ' A' ' 85' ' ' SER . 0.1 OUTLIER -91.08 133.58 35.21 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.478 179.587 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.628 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 4.9 t 98.22 17.11 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.993 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.787 HG21 ' NE2' ' A' ' 83' ' ' HIS . 9.1 t -96.3 33.81 1.71 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.431 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 18.2 m -84.02 60.19 5.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.194 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.415 ' O ' ' O ' ' A' ' 89' ' ' TYR . 4.1 m-30 -124.46 121.64 35.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.797 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.415 ' O ' ' O ' ' A' ' 88' ' ' TYR . 14.5 m-30 -39.09 160.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.034 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -98.73 64.44 1.48 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.124 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -110.43 98.1 7.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.716 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.216 -0.897 . . . . 0.0 111.029 -179.813 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 1.019 ' H82' HD11 ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.614 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 180' ' ' BMA . . . . . 0.435 ' C1 ' ' O6 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 183' ' ' NAG . . . . . 0.498 ' O3 ' ' C1 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 186' ' ' GAL . . . . . 0.498 ' C1 ' ' O3 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 121.013 0.435 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -46.8 172.47 0.03 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 123.236 2.624 . . . . 0.0 112.453 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -119.78 -53.55 2.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.984 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 34.7 m -124.17 -146.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.803 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -102.59 139.77 37.75 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.75 0.309 . . . . 0.0 111.236 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.482 ' O ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -160.65 178.95 8.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.856 179.858 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.482 ' O ' ' O ' ' A' ' 6' ' ' ASP . 0.1 OUTLIER 56.02 150.7 0.06 OUTLIER Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.607 -179.652 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.472 ' O ' ' O ' ' A' ' 31' ' ' CYS . 11.7 Cg_endo -55.17 -164.2 0.01 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.495 2.13 . . . . 0.0 111.875 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.569 ' OE1' ' CZ ' ' A' ' 33' ' ' PHE . 0.1 OUTLIER -117.87 161.76 19.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.057 0.456 . . . . 0.0 111.143 -179.892 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.499 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 47.3 t -61.63 125.27 23.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.382 -179.624 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.678 ' O ' HD12 ' A' ' 12' ' ' LEU . 1.0 OUTLIER -149.75 -144.11 0.15 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.521 179.492 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.846 HD23 HD13 ' A' ' 26' ' ' LEU . 6.1 mp -122.27 138.19 54.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.154 0.502 . . . . 0.0 111.093 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.63 ' O ' ' C ' ' A' ' 14' ' ' GLU . 2.3 mt-30 -96.15 44.97 1.07 Allowed 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.197 -179.593 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.66 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 21.8 tt0 -2.53 116.63 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 114.143 -1.389 . . . . 0.0 110.66 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.746 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.9 OUTLIER -56.03 103.1 0.34 Allowed Pre-proline 0 C--N 1.304 -1.4 0 CA-C-N 114.223 -1.353 . . . . 0.0 112.367 -178.8 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.553 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 72.6 Cg_endo -75.37 10.27 1.89 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.247 1.965 . . . . 0.0 109.887 177.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.576 ' CZ ' ' SD ' ' A' ' 71' ' ' MET . 0.8 OUTLIER -106.06 -59.55 1.76 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.212 -1.358 . . . . 0.0 110.879 -179.478 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.768 ' HD2' HG21 ' A' ' 25' ' ' ILE . 8.8 m-85 -80.34 -1.71 42.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.822 -179.032 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.464 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 27.4 t -48.94 93.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.841 0.353 . . . . 0.0 110.179 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.543 ' O ' ' N ' ' A' ' 22' ' ' GLY . 2.8 mt-30 -91.43 168.38 13.56 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.921 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.417 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 27.2 Cg_exo -62.55 59.69 0.14 Allowed 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.708 2.272 . . . . 0.0 111.462 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.543 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 138.62 5.21 1.51 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.898 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 1.009 ' CB ' ' H83' ' A' ' 178' ' ' NAG . . . -150.98 101.69 3.02 Favored Pre-proline 0 CA--C 1.511 -0.543 0 CA-C-O 122.082 0.944 . . . . 0.0 111.938 -179.612 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.587 ' O ' ' O ' ' A' ' 25' ' ' ILE . 18.6 Cg_endo -96.17 81.24 0.1 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.464 0 C-N-CA 124.504 3.469 . . . . 0.0 112.708 -179.279 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.244 ' CG2' HG21 ' A' ' 76' ' ' VAL . 12.6 mm -42.01 -175.59 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.95 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -153.72 -160.37 1.1 Allowed 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 -175.229 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.539 ' O ' ' O ' ' A' ' 28' ' ' CYS . 1.8 tt0 162.53 64.06 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 112.523 -2.126 . . . . 0.0 111.429 179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.647 ' HB2' ' CE1' ' A' ' 79' ' ' HIS . 0.6 OUTLIER 6.91 121.0 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 179.772 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.612 ' HA ' ' HG3' ' A' ' 13' ' ' GLN . 3.2 ttp -65.82 -72.3 0.16 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.904 177.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.45 ' N ' ' HG2' ' A' ' 29' ' ' MET . . . 102.02 104.72 2.81 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.731 -0.747 . . . . 0.0 113.112 179.322 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.559 ' O ' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -164.45 66.07 0.15 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.803 0.335 . . . . 0.0 110.882 179.387 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.499 ' SG ' ' HB2' ' A' ' 10' ' ' CYS . 85.2 m -97.65 -151.16 0.36 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.548 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.569 ' CZ ' ' OE1' ' A' ' 9' ' ' GLU . 0.7 OUTLIER -129.83 -162.75 1.23 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.667 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.621 ' O ' ' CB ' ' A' ' 35' ' ' ARG . 0.1 OUTLIER -138.7 123.8 19.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.299 -179.698 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.621 ' CB ' ' O ' ' A' ' 34' ' ' SER . 0.4 OUTLIER 146.83 -172.21 0.0 OUTLIER 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.015 179.568 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.583 ' O ' ' CD2' ' A' ' 37' ' ' TYR . . . -174.0 109.2 0.14 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.009 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.583 ' CD2' ' O ' ' A' ' 36' ' ' ALA . 18.6 m-85 -169.9 106.51 0.45 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.042 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -52.01 174.6 0.08 OUTLIER 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.947 2.432 . . . . 0.0 112.561 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.419 ' HA ' ' HD2' ' A' ' 40' ' ' PRO . 49.6 m -51.84 123.02 23.85 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.22 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.474 ' O ' ' C ' ' A' ' 41' ' ' LEU . 13.1 Cg_endo -57.38 169.51 2.2 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.744 2.296 . . . . 0.0 111.911 179.505 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.474 ' C ' ' O ' ' A' ' 40' ' ' PRO . 2.5 mt -31.27 -61.12 0.21 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.005 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.471 ' O ' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -42.17 170.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.973 -179.858 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.526 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -113.48 -66.13 1.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.992 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 43' ' ' SER . 1.7 mttm 73.04 -106.96 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.973 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.55 ' O ' ' OG1' ' A' ' 46' ' ' THR . 0.1 OUTLIER -126.82 -159.88 0.96 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.784 0.326 . . . . 0.0 111.177 -179.564 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.55 ' OG1' ' O ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER 70.67 48.0 0.45 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.979 -179.77 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.462 ' C ' ' O ' ' A' ' 46' ' ' THR . 6.2 mtp 32.23 -134.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.001 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.563 ' C ' HG23 ' A' ' 49' ' ' VAL . 2.5 mt -138.43 -170.04 2.73 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.629 0.252 . . . . 0.0 110.92 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.563 HG23 ' C ' ' A' ' 48' ' ' LEU . 0.3 OUTLIER 60.97 117.84 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.619 -179.576 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -70.63 145.03 50.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.116 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.488 ' HA ' ' HD3' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -118.81 33.7 5.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.773 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.58 159.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.385 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.407 ' C ' ' OG1' ' A' ' 54' ' ' THR . 0.0 OUTLIER -138.8 13.01 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.371 -179.953 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.422 ' HB ' ' CB ' ' A' ' 85' ' ' SER . 0.0 OUTLIER 58.45 45.15 17.02 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.002 179.982 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.514 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -49.28 162.84 0.12 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.373 -179.837 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.514 ' HB2' ' O ' ' A' ' 55' ' ' SER . 0.1 OUTLIER 83.92 90.63 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.394 179.572 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 59.9 179.72 0.09 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.547 179.447 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.483 ' HA ' ' HA ' ' A' ' 85' ' ' SER . 9.6 p -148.71 165.04 32.58 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.821 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.487 ' O ' HG22 ' A' ' 86' ' ' THR . 0.2 OUTLIER 163.66 127.09 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.903 0.382 . . . . 0.0 111.075 179.789 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 3.6 m -86.32 140.7 29.82 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.072 0.463 . . . . 0.0 111.544 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.766 ' O ' HG12 ' A' ' 61' ' ' VAL . 73.2 t -157.48 55.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.027 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.575 ' HA ' ' HA ' ' A' ' 82' ' ' CYS . . . 31.87 103.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.891 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.768 ' N ' ' O ' ' A' ' 81' ' ' ALA . 3.1 tptt -51.92 -36.33 48.63 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.706 0.765 . . . . 0.0 109.23 178.601 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.612 ' O ' ' N ' ' A' ' 80' ' ' THR . 74.9 m -150.08 118.84 6.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.39 -1.277 . . . . 0.0 109.919 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.846 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -105.23 166.31 10.5 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.531 0.681 . . . . 0.0 112.293 -178.811 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.793 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 0.1 OUTLIER -130.9 27.09 4.93 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-O 122.593 1.187 . . . . 0.0 107.921 177.399 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.686 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 12.9 ptt85 -11.0 100.7 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 112.475 -2.148 . . . . 0.0 111.689 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 1.015 HG13 ' HB2' ' A' ' 78' ' ' ASN . 4.2 m -98.32 45.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 CA-C-N 114.939 -1.028 . . . . 0.0 110.502 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.67 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 53.0 m -21.52 118.9 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.027 -179.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.831 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.2 OUTLIER -126.12 -167.49 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.784 0.802 . . . . 0.0 112.474 -178.457 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.658 ' H ' HG12 ' A' ' 70' ' ' VAL . 0.0 OUTLIER 39.17 -132.73 0.18 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.969 -179.888 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -78.97 19.65 5.13 Favored Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.735 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 113.06 41.43 0.98 Allowed Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.634 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.67 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.2 m-85 -72.53 178.6 3.96 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.604 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 5.9 mtmm -155.14 108.23 2.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.193 0.521 . . . . 0.0 111.454 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.244 HG21 ' CG2' ' A' ' 25' ' ' ILE . 15.4 m -106.59 15.02 7.52 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.483 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.337 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.846 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.6 OUTLIER 28.41 40.21 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 105.787 -1.931 . . . . 0.0 105.787 -176.876 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 1.015 ' HB2' HG13 ' A' ' 68' ' ' VAL . 29.1 t30 -4.89 68.92 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 113.402 -1.726 . . . . 0.0 108.722 -174.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.95 ' N ' HD12 ' A' ' 26' ' ' LEU . 36.4 m170 -37.77 122.11 0.95 Allowed 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 112.945 -1.934 . . . . 0.0 113.909 -176.594 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.612 ' N ' ' O ' ' A' ' 64' ' ' SER . 2.1 p -109.12 -11.73 14.9 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 113.048 -1.887 . . . . 0.0 109.211 178.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.768 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -172.38 142.49 1.31 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.4 179.01 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 8.1 m -120.82 146.22 46.78 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.679 0.276 . . . . 0.0 110.494 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.556 ' O ' ' HA ' ' A' ' 60' ' ' CYS . 0.8 OUTLIER -138.51 114.02 9.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.816 0.341 . . . . 0.0 111.8 -179.061 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.538 ' O ' ' CB ' ' A' ' 85' ' ' SER . 0.1 OUTLIER -77.69 89.09 3.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.803 179.415 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 3.0 p 158.25 94.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.106 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.53 ' HB ' ' O ' ' A' ' 85' ' ' SER . 4.4 t 170.94 47.39 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.946 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.429 ' HB2' ' HB2' ' A' ' 59' ' ' CYS . 0.5 OUTLIER -117.4 126.03 51.97 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.038 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -73.74 73.05 1.53 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.647 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -93.17 -167.55 1.74 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.428 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.52 ' ND1' ' O ' ' A' ' 90' ' ' HIS . 40.1 t-80 -142.23 71.21 1.34 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.786 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.484 ' O ' ' CB ' ' A' ' 92' ' ' SER . 0.2 OUTLIER -130.73 -78.27 0.53 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.79 179.955 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.484 ' CB ' ' O ' ' A' ' 91' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.872 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 1.009 ' H83' ' CB ' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.606 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.846 ' H3 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 185' ' ' GAL . . . . . 0.846 ' O2 ' ' H3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.697 ' HB3' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.893 0.377 . . . . 0.0 111.011 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.697 ' HD3' ' HB3' ' A' ' 1' ' ' ALA . 24.4 Cg_exo -63.03 -165.43 0.05 OUTLIER 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.853 2.369 . . . . 0.0 112.039 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -75.65 -62.64 1.51 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.67 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.49 ' O ' HG13 ' A' ' 4' ' ' VAL . 1.4 p -153.27 17.71 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.188 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -88.48 172.63 9.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.779 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -98.91 149.6 22.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.046 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -139.42 140.92 27.1 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.488 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -86.5 -177.88 2.51 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 122.87 2.38 . . . . 0.0 112.528 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.856 ' O ' HG22 ' A' ' 11' ' ' THR . 0.9 OUTLIER -86.14 137.81 32.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.031 0.443 . . . . 0.0 110.957 -179.834 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.439 ' N ' ' HG2' ' A' ' 9' ' ' GLU . 12.6 t -43.79 115.14 0.75 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.427 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.856 HG22 ' O ' ' A' ' 9' ' ' GLU . 3.9 t -175.86 -169.48 0.34 Allowed 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 121.183 0.516 . . . . 0.0 111.106 179.078 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.108 ' CD2' HD13 ' A' ' 26' ' ' LEU . 8.0 mp -85.9 130.31 34.58 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.465 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.614 ' O ' ' C ' ' A' ' 14' ' ' GLU . 2.0 mt-30 -91.39 49.01 1.54 Allowed 'General case' 0 CA--C 1.5 -0.95 0 CA-C-O 121.905 0.86 . . . . 0.0 110.278 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.614 ' C ' ' O ' ' A' ' 13' ' ' GLN . 27.5 tt0 -1.15 113.81 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 113.339 -1.755 . . . . 0.0 110.864 -178.575 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.925 ' ND2' HG11 ' A' ' 76' ' ' VAL . 1.4 t-20 -41.0 100.69 0.23 Allowed Pre-proline 0 C--N 1.301 -1.528 0 CA-C-N 113.293 -1.776 . . . . 0.0 112.349 -179.191 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -68.74 4.83 1.56 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.272 1.981 . . . . 0.0 110.664 178.42 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.586 ' CZ ' ' HG3' ' A' ' 71' ' ' MET . 10.9 t80 -110.63 -56.47 2.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.965 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.939 ' CE2' HG13 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -73.16 -26.53 61.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.535 179.777 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.531 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 8.9 m -47.26 97.57 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.928 -179.652 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.627 ' O ' ' N ' ' A' ' 22' ' ' GLY . 8.7 tt0 -136.04 139.7 31.01 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.443 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.485 ' HD2' ' HG3' ' A' ' 20' ' ' GLN . 87.9 Cg_exo -35.36 81.84 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.747 2.298 . . . . 0.0 112.417 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.627 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 130.93 -6.32 5.76 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.503 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.456 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . -159.73 101.65 1.47 Allowed Pre-proline 0 CA--C 1.513 -0.463 0 CA-C-O 121.992 0.901 . . . . 0.0 111.862 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.645 ' HD2' ' H3 ' ' A' ' 178' ' ' NAG . 91.6 Cg_endo -106.24 65.94 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.506 0 C-N-CA 124.981 3.787 . . . . 0.0 113.469 -178.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.195 ' CG2' HG21 ' A' ' 76' ' ' VAL . 16.2 mm -41.81 -176.41 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.368 179.172 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.108 HD13 ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -150.62 -160.52 1.18 Allowed 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -175.403 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.586 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 17.5 tt0 166.25 63.01 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 112.706 -2.043 . . . . 0.0 110.998 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.643 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 94.3 m -20.1 111.73 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.733 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.55 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -159.21 104.48 1.68 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.927 179.274 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -149.28 -133.79 2.26 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.602 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.2 m -153.4 122.51 6.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.684 0.278 . . . . 0.0 110.73 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 3.3 m -92.57 109.86 21.27 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.848 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -101.5 157.94 16.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.336 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.6 t 177.19 -71.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.593 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.2 mtp180 39.21 -160.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.104 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.564 ' O ' ' HB2' ' A' ' 37' ' ' TYR . . . -75.04 103.0 5.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.366 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.564 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 15.2 t80 153.28 65.59 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.7 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.67 176.13 10.49 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 C-N-CA 122.747 2.298 . . . . 0.0 112.595 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.481 ' HB ' ' CD ' ' A' ' 40' ' ' PRO . 4.3 p -150.03 169.08 9.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.858 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.481 ' CD ' ' HB ' ' A' ' 39' ' ' THR . 11.9 Cg_exo -70.17 -24.6 27.6 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.936 2.424 . . . . 0.0 112.057 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.422 ' O ' ' HB2' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -97.49 51.98 1.1 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.782 -179.892 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.422 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 1.3 tmm_? 167.88 -26.0 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.269 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.447 ' HB3' ' O ' ' A' ' 39' ' ' THR . 29.2 t -118.93 17.39 13.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.356 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? 54.97 -165.99 0.1 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.604 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -102.68 -22.79 13.9 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.787 0.327 . . . . 0.0 111.051 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -113.22 160.43 18.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.098 0.475 . . . . 0.0 111.344 -179.74 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.58 ' HG2' ' O ' ' A' ' 47' ' ' MET . 0.0 OUTLIER -176.52 93.69 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.534 179.549 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.624 ' C ' HG23 ' A' ' 49' ' ' VAL . 0.0 OUTLIER -103.82 72.78 1.13 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.27 -179.491 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.624 HG23 ' C ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER 55.03 166.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.929 0.395 . . . . 0.0 111.247 179.728 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -169.86 140.96 2.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.732 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -61.48 133.08 55.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.142 -179.722 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.406 ' HB2' ' O ' ' A' ' 51' ' ' LYS . 5.8 m120 64.71 107.62 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.089 179.641 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.499 ' O ' ' CB ' ' A' ' 54' ' ' THR . 35.4 t -140.32 153.66 22.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.296 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.565 ' CG2' ' O ' ' A' ' 54' ' ' THR . 0.4 OUTLIER 84.8 109.9 0.05 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.816 179.748 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.479 ' O ' ' C ' ' A' ' 56' ' ' GLU . 3.5 p -123.09 93.08 3.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.55 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.479 ' C ' ' O ' ' A' ' 55' ' ' SER . 0.1 OUTLIER -28.97 -96.07 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.52 -179.696 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -121.4 130.86 53.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.852 0.358 . . . . 0.0 111.013 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.505 ' HA ' ' HA ' ' A' ' 86' ' ' THR . 42.1 p -106.07 -176.67 3.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.086 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.55 ' SG ' ' N ' ' A' ' 87' ' ' CYS . 0.3 OUTLIER -157.97 126.03 5.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.384 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 82' ' ' CYS . 0.6 OUTLIER -75.89 104.07 6.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.595 -179.499 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.518 ' O ' ' C ' ' A' ' 62' ' ' ALA . 18.0 t -102.38 73.7 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.342 179.09 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.739 ' HB1' ' O ' ' A' ' 64' ' ' SER . . . 13.0 99.65 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -179.264 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.925 ' N ' ' O ' ' A' ' 81' ' ' ALA . 0.9 OUTLIER -50.29 -35.24 26.5 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.307 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.739 ' O ' ' HB1' ' A' ' 62' ' ' ALA . 22.6 m -136.28 -174.88 3.81 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 113.768 -1.56 . . . . 0.0 108.877 179.164 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.723 ' HB3' ' HB3' ' A' ' 77' ' ' GLU . 1.8 p90 -164.05 162.97 23.38 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.498 0.666 . . . . 0.0 112.331 -179.531 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.827 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -134.99 29.36 3.43 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 176.468 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.736 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 1.8 ptt85 -10.76 130.0 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 112.109 -2.314 . . . . 0.0 112.368 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 1.013 HG21 HG13 ' A' ' 25' ' ' ILE . 2.5 m -135.28 38.2 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.094 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.586 ' C ' ' O ' ' A' ' 68' ' ' VAL . 23.1 m -4.5 119.23 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.661 -1.154 . . . . 0.0 112.336 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.939 HG13 ' CE2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -111.16 -161.29 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-O 121.78 0.8 . . . . 0.0 111.593 179.108 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.586 ' HG3' ' CZ ' ' A' ' 17' ' ' PHE . 3.7 mtt -30.89 153.6 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.901 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 42.13 25.85 0.29 Allowed Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.46 -0.876 . . . . 0.0 111.552 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.503 ' C ' HG23 ' A' ' 69' ' ' THR . . . 68.96 30.82 72.22 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.128 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.586 ' HB2' HG23 ' A' ' 70' ' ' VAL . 8.0 m-30 -46.59 179.36 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.625 0.25 . . . . 0.0 110.331 179.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.53 ' CG ' ' O ' ' A' ' 74' ' ' PHE . 9.7 mtpt -161.58 93.0 0.9 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.133 0.492 . . . . 0.0 111.432 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.195 HG21 ' CG2' ' A' ' 25' ' ' ILE . 27.3 m -85.82 9.1 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.486 -1.488 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.903 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.738 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 29.49 39.62 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 -177.084 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.857 ' HB2' HG13 ' A' ' 68' ' ' VAL . 61.3 t30 3.91 62.15 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 113.123 -1.853 . . . . 0.0 108.448 -174.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 1.042 ' O ' HD21 ' A' ' 12' ' ' LEU . 35.7 m170 -31.7 120.95 0.27 Allowed 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 112.778 -2.01 . . . . 0.0 113.7 -176.742 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.501 ' OG1' ' HB2' ' A' ' 64' ' ' SER . 7.5 p -107.7 -10.88 15.53 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 113.84 -1.527 . . . . 0.0 110.1 179.424 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.925 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -170.44 133.03 1.02 Allowed 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.908 178.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.594 ' SG ' ' CD1' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -116.67 142.38 46.97 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.27 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.469 ' O ' ' CG ' ' A' ' 83' ' ' HIS . 0.6 OUTLIER -126.1 115.17 19.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.816 0.341 . . . . 0.0 110.828 179.635 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 68.3 m -58.8 105.76 0.34 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.026 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.488 ' O ' ' SG ' ' A' ' 59' ' ' CYS . 0.9 OUTLIER -144.42 115.5 7.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.139 179.907 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.505 ' HA ' ' HA ' ' A' ' 58' ' ' THR . 0.2 OUTLIER -30.87 153.5 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.359 179.861 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.55 ' N ' ' SG ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER -115.25 46.09 1.52 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.713 179.759 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.426 ' O ' ' C ' ' A' ' 89' ' ' TYR . 1.2 m-30 -119.38 62.72 0.8 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.767 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 88' ' ' TYR . 0.4 OUTLIER 36.21 80.81 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.738 -179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -148.43 135.3 19.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.929 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -118.87 102.43 8.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.828 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.275 -0.869 . . . . 0.0 110.808 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 0.939 ' H82' HD11 ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 183' ' ' NAG . . . . . 0.772 ' H5 ' ' H2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.441 ' O7 ' ' H3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 186' ' ' GAL . . . . . 0.772 ' H2 ' ' H5 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.404 ' HA ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.872 0.367 . . . . 0.0 111.042 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 1' ' ' ALA . 25.7 Cg_endo -62.23 120.76 8.48 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.649 2.233 . . . . 0.0 111.83 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -88.01 47.2 1.47 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.355 -179.51 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.562 ' O ' ' O ' ' A' ' 5' ' ' GLN . 1.0 OUTLIER -106.9 -0.58 9.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.941 0.4 . . . . 0.0 110.898 179.574 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.562 ' O ' ' O ' ' A' ' 4' ' ' VAL . 3.1 mt-30 29.11 -154.64 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.153 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 41.22 64.88 0.91 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.075 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -44.44 136.6 4.19 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 120.822 0.344 . . . . 0.0 110.729 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.427 ' HD2' ' SG ' ' A' ' 31' ' ' CYS . 35.0 Cg_endo -64.54 -160.77 0.04 OUTLIER 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.703 2.269 . . . . 0.0 112.213 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 56.1 tt0 -93.9 158.15 15.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.536 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.446 ' HB2' ' C ' ' A' ' 31' ' ' CYS . 14.6 t -100.3 147.22 26.02 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.031 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.637 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 3.7 t -178.92 -167.76 0.12 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.419 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.023 HD23 HD13 ' A' ' 26' ' ' LEU . 3.9 mp -97.2 139.21 33.51 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.392 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.634 ' O ' ' O ' ' A' ' 14' ' ' GLU . 28.7 mt-30 -111.24 55.04 0.66 Allowed 'General case' 0 CA--C 1.505 -0.752 0 CA-C-O 121.658 0.742 . . . . 0.0 110.736 179.093 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.634 ' O ' ' O ' ' A' ' 13' ' ' GLN . 14.7 tt0 -0.16 122.63 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 113.651 -1.613 . . . . 0.0 111.311 -179.555 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.802 ' HB2' HG22 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -63.46 102.69 0.34 Allowed Pre-proline 0 C--N 1.305 -1.341 0 CA-C-N 114.107 -1.406 . . . . 0.0 112.7 -179.015 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.537 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 6.3 Cg_exo -76.72 5.09 5.08 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.632 2.221 . . . . 0.0 109.41 177.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.525 ' HB3' ' OD1' ' A' ' 15' ' ' ASN . 0.9 OUTLIER -96.85 -62.28 1.28 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 113.86 -1.518 . . . . 0.0 110.525 -179.668 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 1.132 ' CG ' HG21 ' A' ' 70' ' ' VAL . 7.3 m-85 -77.76 -4.86 48.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.86 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.488 ' HA ' ' O ' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -52.23 91.52 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.127 179.477 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.673 ' O ' ' N ' ' A' ' 22' ' ' GLY . 4.6 mt-30 -95.09 162.59 24.39 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.357 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.573 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 11.4 Cg_endo -54.86 63.48 0.03 OUTLIER 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.761 2.307 . . . . 0.0 111.802 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.673 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 143.53 1.08 1.07 Allowed Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.805 -0.712 . . . . 0.0 113.133 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.992 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -155.13 108.61 2.27 Favored Pre-proline 0 CA--C 1.518 -0.258 0 CA-C-O 122.074 0.94 . . . . 0.0 112.804 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.8 ' HD2' ' H3 ' ' A' ' 178' ' ' NAG . 94.9 Cg_endo -98.78 78.52 0.05 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.073 0 C-N-CA 124.844 3.696 . . . . 0.0 112.913 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.23 ' CG2' HG21 ' A' ' 76' ' ' VAL . 5.1 mm -43.9 -176.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.026 HD23 ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.21 -164.87 2.07 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 122.343 1.068 . . . . 0.0 113.612 -176.297 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.662 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER 165.55 78.87 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 112.939 -1.937 . . . . 0.0 111.051 178.868 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.637 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -13.35 114.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.265 -179.851 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.591 ' HB2' ' CG ' ' A' ' 13' ' ' GLN . 9.8 mmm -126.99 123.87 38.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.885 0.374 . . . . 0.0 111.241 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 136.72 -145.48 17.34 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.382 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.446 ' C ' ' HB2' ' A' ' 10' ' ' CYS . 1.6 p -163.21 170.38 17.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.82 0.343 . . . . 0.0 110.811 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.45 -167.49 0.18 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.809 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.442 ' CD1' ' N ' ' A' ' 33' ' ' PHE . 3.3 m-85 -106.14 -159.13 0.69 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.546 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.7 p -148.58 -158.92 0.96 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.835 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.472 ' O ' ' CG ' ' A' ' 35' ' ' ARG . 1.6 ptm180 -105.19 36.94 2.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.723 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 60.6 151.13 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.899 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.421 ' O ' ' O ' ' A' ' 38' ' ' PRO . 47.0 t80 -137.01 78.78 39.99 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.7 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.421 ' O ' ' O ' ' A' ' 37' ' ' TYR . 52.8 Cg_exo -53.54 -159.02 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.855 2.37 . . . . 0.0 112.238 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.512 HG22 HD21 ' A' ' 41' ' ' LEU . 0.6 OUTLIER -121.36 63.84 13.84 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.638 179.818 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.478 ' C ' HD23 ' A' ' 41' ' ' LEU . 26.9 Cg_endo -62.58 118.51 5.41 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.84 2.36 . . . . 0.0 112.183 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.512 HD21 HG22 ' A' ' 39' ' ' THR . 9.9 mt -114.26 -161.69 0.78 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.237 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.45 ' O ' ' CG ' ' A' ' 42' ' ' ARG . 5.9 tpt180 -85.52 55.16 3.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.652 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 39.1 t -143.32 -74.64 0.27 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.791 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -146.37 -160.88 1.21 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.854 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.64 95.2 2.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.775 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.4 ' O ' ' C ' ' A' ' 47' ' ' MET . 20.1 p -96.73 -153.66 0.42 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.018 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.4 ' C ' ' O ' ' A' ' 46' ' ' THR . 0.1 OUTLIER 38.03 47.47 0.94 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.794 179.948 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -150.38 94.71 2.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.063 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.554 HG23 ' CD ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -113.13 -172.02 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.638 179.563 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -83.52 68.31 9.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.933 0.397 . . . . 0.0 111.331 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.554 ' CD ' HG23 ' A' ' 49' ' ' VAL . 12.6 mtpp -106.57 100.42 9.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.373 179.493 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.477 ' C ' ' O ' ' A' ' 51' ' ' LYS . 47.6 t-20 -31.24 99.29 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.14 -179.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 37.9 t -55.62 145.49 5.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.9 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 69.5 p -86.07 -133.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.493 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.8 -178.31 3.52 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.741 0.305 . . . . 0.0 111.134 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -115.03 -97.37 0.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.954 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.516 ' OG ' ' N ' ' A' ' 58' ' ' THR . 1.2 t -39.59 -92.85 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.046 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.798 HG22 ' HA ' ' A' ' 85' ' ' SER . 0.0 OUTLIER 51.93 164.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.816 -179.927 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 61.7 m -153.01 150.19 28.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.951 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -95.87 128.8 43.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.821 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.539 ' O ' HG12 ' A' ' 61' ' ' VAL . 61.0 t -131.56 64.47 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.738 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.58 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 21.15 103.43 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.992 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.86 ' N ' ' O ' ' A' ' 81' ' ' ALA . 15.1 tttt -54.18 -35.67 62.58 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.538 0.685 . . . . 0.0 109.335 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.537 ' O ' ' N ' ' A' ' 80' ' ' THR . 37.1 m -146.3 127.41 14.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.379 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.854 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -112.31 166.11 11.58 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.594 0.711 . . . . 0.0 112.576 -178.343 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.715 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -133.1 29.52 4.04 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 114.612 -1.176 . . . . 0.0 108.198 177.393 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.737 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.8 OUTLIER -16.13 125.31 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 112.426 -2.17 . . . . 0.0 111.6 -179.718 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.99 HG11 ' H82' ' A' ' 178' ' ' NAG . 2.7 m -128.57 41.92 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.328 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.65 ' C ' ' O ' ' A' ' 68' ' ' VAL . 55.0 m -9.75 118.35 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.665 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 1.132 HG21 ' CG ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -124.45 -171.1 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 121.52 0.676 . . . . 0.0 111.962 -178.765 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.476 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 42.6 mmm 34.3 -127.65 0.08 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.829 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -81.69 26.27 3.69 Favored Glycine 0 N--CA 1.44 -1.057 0 CA-C-N 115.498 -0.774 . . . . 0.0 112.566 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.607 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 104.69 43.02 1.74 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.468 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.612 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.0 m-85 -85.79 116.1 23.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.811 0.339 . . . . 0.0 111.011 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -99.65 104.5 16.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.121 0.486 . . . . 0.0 112.243 -179.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.23 HG21 ' CG2' ' A' ' 25' ' ' ILE . 12.6 m -92.32 14.64 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.361 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.755 178.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.854 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 29.18 39.94 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 105.508 -2.034 . . . . 0.0 105.508 -176.426 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.724 ' HB2' HG13 ' A' ' 68' ' ' VAL . 46.6 t30 -2.2 67.9 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.828 0 CA-C-N 113.245 -1.798 . . . . 0.0 108.53 -175.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 1.025 ' N ' HD12 ' A' ' 26' ' ' LEU . 37.6 m170 -35.49 120.48 0.56 Allowed 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 113.264 -1.789 . . . . 0.0 113.877 -176.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.537 ' N ' ' O ' ' A' ' 64' ' ' SER . 3.9 p -111.16 -11.16 14.27 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 113.514 -1.675 . . . . 0.0 110.233 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.86 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -168.83 133.4 1.54 Allowed 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.586 ' SG ' HD11 ' A' ' 12' ' ' LEU . 1.3 m -119.74 137.16 54.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.919 0.39 . . . . 0.0 111.077 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.402 ' O ' ' HA ' ' A' ' 60' ' ' CYS . 0.0 OUTLIER -137.57 130.98 31.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.9 -179.855 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.522 ' O ' ' HB3' ' A' ' 85' ' ' SER . 0.0 OUTLIER -62.88 -175.45 0.09 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.932 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.798 ' HA ' HG22 ' A' ' 58' ' ' THR . 25.6 t 77.34 158.42 0.19 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.099 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 85' ' ' SER . 4.9 p 64.4 114.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.169 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.8 136.83 42.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.709 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 46.19 55.53 7.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.346 -179.735 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.552 ' O ' ' CG ' ' A' ' 89' ' ' TYR . 0.9 OUTLIER -125.1 114.96 19.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.359 -179.484 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -132.12 -177.37 4.42 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.798 179.573 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.15 98.63 0.06 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.62 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.98 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 0.992 ' H83' ' HB1' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.755 ' O7 ' ' C3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 180' ' ' BMA . . . . . 0.665 ' H4 ' ' C5 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 182' ' ' MAN . . . . . 0.665 ' C5 ' ' H4 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 183' ' ' NAG . . . . . 0.407 ' O7 ' ' H3 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.521 ' O7 ' ' O3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.969 ' HB3' ' HB ' ' A' ' 4' ' ' VAL . . . . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.977 0.418 . . . . 0.0 111.068 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -62.07 78.86 0.1 OUTLIER 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.785 2.323 . . . . 0.0 112.344 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.466 ' OD1' ' N ' ' A' ' 3' ' ' ASP . 0.2 OUTLIER 74.81 46.68 0.13 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.113 179.847 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.969 ' HB ' ' HB3' ' A' ' 1' ' ' ALA . 48.7 t -134.56 68.23 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.017 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.435 ' O ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER 67.24 132.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.817 -179.841 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.435 ' O ' ' O ' ' A' ' 5' ' ' GLN . 6.9 m-20 -51.1 -172.86 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.914 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.407 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.1 OUTLIER -36.84 127.54 0.75 Allowed Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.964 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 7' ' ' CYS . 37.0 Cg_exo -59.45 -160.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.799 2.332 . . . . 0.0 112.037 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -105.18 135.3 46.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.196 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.507 ' HA ' ' HA3' ' A' ' 30' ' ' GLY . 3.0 t -41.37 131.18 2.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.314 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.75 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 1.7 t -155.48 -163.65 1.57 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.259 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.055 HD21 ' O ' ' A' ' 79' ' ' HIS . 6.8 mp -98.32 138.69 35.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.015 0.436 . . . . 0.0 111.812 -179.222 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.707 ' O ' ' O ' ' A' ' 14' ' ' GLU . 20.2 mt-30 -115.14 52.28 0.87 Allowed 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 121.713 0.768 . . . . 0.0 110.79 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.707 ' O ' ' O ' ' A' ' 13' ' ' GLN . 8.3 tt0 7.7 126.35 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 113.327 -1.76 . . . . 0.0 112.336 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.8 ' OD1' HG11 ' A' ' 76' ' ' VAL . 0.0 OUTLIER -53.81 108.74 1.2 Allowed Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.249 179.616 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -74.12 20.71 0.4 Allowed 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.22 1.947 . . . . 0.0 111.727 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.622 ' CZ ' ' HG2' ' A' ' 71' ' ' MET . 34.8 t80 -128.34 -55.4 1.25 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.58 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 1.023 ' CD2' HG13 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -71.69 -24.34 61.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.685 -179.772 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.664 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.2 m -40.03 92.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.182 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.607 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -124.29 138.89 31.68 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.592 -179.394 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.508 ' N ' ' OE1' ' A' ' 20' ' ' GLN . 83.4 Cg_exo -37.41 83.67 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.534 2.156 . . . . 0.0 112.08 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.607 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 127.37 -9.59 6.94 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.537 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.653 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -154.75 99.48 2.41 Favored Pre-proline 0 CA--C 1.512 -0.508 0 CA-C-O 122.011 0.91 . . . . 0.0 111.486 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.7 ' O ' ' O ' ' A' ' 25' ' ' ILE . 71.7 Cg_endo -103.63 66.67 0.03 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.57 0 C-N-CA 124.954 3.769 . . . . 0.0 112.608 -178.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.198 ' CG2' HG21 ' A' ' 76' ' ' VAL . 25.1 mm -37.59 -178.03 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.002 0 CA-C-N 115.322 -0.853 . . . . 0.0 113.284 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.922 HD13 ' O ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -153.78 -159.57 0.99 Allowed 'General case' 0 CA--C 1.498 -1.054 0 CA-C-O 122.726 1.25 . . . . 0.0 114.193 -175.343 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.598 ' O ' ' C ' ' A' ' 28' ' ' CYS . 3.4 tt0 168.58 65.85 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 112.716 -2.038 . . . . 0.0 111.297 179.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.75 ' HA ' ' O ' ' A' ' 11' ' ' THR . 68.0 m -5.98 113.04 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.935 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.616 ' N ' ' O ' ' A' ' 11' ' ' THR . 3.3 tpp -141.29 108.9 5.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.84 0.352 . . . . 0.0 111.226 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.507 ' HA3' ' HA ' ' A' ' 10' ' ' CYS . . . -162.63 -130.12 1.09 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.356 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.41 ' O ' ' O ' ' A' ' 32' ' ' CYS . 0.0 OUTLIER -143.77 116.79 8.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.746 0.308 . . . . 0.0 110.965 -179.941 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.434 ' HB3' ' HB3' ' A' ' 84' ' ' CYS . 56.4 m -53.04 -169.57 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.001 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.468 ' O ' ' CB ' ' A' ' 34' ' ' SER . 0.7 OUTLIER -124.22 163.28 21.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.557 179.734 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.468 ' CB ' ' O ' ' A' ' 33' ' ' PHE . 1.3 t 82.25 53.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.711 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.412 ' N ' ' CD ' ' A' ' 35' ' ' ARG . 0.1 OUTLIER -53.25 126.9 22.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.951 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -124.82 174.26 8.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.885 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -120.36 155.54 56.16 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.938 0.399 . . . . 0.0 111.066 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -61.43 -175.84 0.16 Allowed 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.957 2.438 . . . . 0.0 112.514 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.422 ' O ' ' N ' ' A' ' 41' ' ' LEU . 0.8 OUTLIER -50.78 105.16 0.48 Allowed Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.851 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.503 ' O ' ' C ' ' A' ' 41' ' ' LEU . 24.1 Cg_exo -63.99 67.12 0.21 Allowed 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.918 2.412 . . . . 0.0 111.841 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.542 ' O ' ' CB ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -26.7 123.65 0.08 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.331 -179.588 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.542 ' CB ' ' O ' ' A' ' 41' ' ' LEU . 0.6 OUTLIER 155.79 -31.5 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.457 179.917 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.436 ' O ' ' O ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER 58.67 -80.83 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.152 179.62 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.508 ' HG3' ' SD ' ' A' ' 47' ' ' MET . 0.8 OUTLIER 59.57 134.31 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.774 -179.778 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.544 ' O ' ' O ' ' A' ' 46' ' ' THR . 0.1 OUTLIER -111.62 140.6 46.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.942 0.401 . . . . 0.0 111.515 -179.546 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.57 ' O ' ' HB3' ' A' ' 47' ' ' MET . 1.0 OUTLIER 27.83 105.66 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.095 179.33 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.57 ' HB3' ' O ' ' A' ' 46' ' ' THR . 20.3 ptm 155.07 161.52 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.651 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.516 ' CB ' ' O ' ' A' ' 47' ' ' MET . 0.2 OUTLIER 85.15 -174.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.944 179.994 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -127.57 -154.15 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.016 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 75.32 165.25 0.27 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.069 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.475 ' HE3' ' OG1' ' A' ' 54' ' ' THR . 0.0 OUTLIER -73.85 172.57 11.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.751 179.975 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.409 ' O ' ' O ' ' A' ' 53' ' ' VAL . 23.9 p30 -105.67 144.79 31.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.87 0.367 . . . . 0.0 111.146 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.409 ' O ' ' O ' ' A' ' 52' ' ' ASN . 10.5 t 57.96 149.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.34 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.716 ' O ' ' CB ' ' A' ' 55' ' ' SER . 2.8 m 177.74 135.65 0.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.37 -179.732 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.716 ' CB ' ' O ' ' A' ' 54' ' ' THR . 44.2 t 120.17 87.26 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.93 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.509 ' OE1' ' HA ' ' A' ' 85' ' ' SER . 0.0 OUTLIER -67.03 176.37 2.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.738 179.719 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.471 ' O ' ' O ' ' A' ' 58' ' ' THR . 14.4 p -74.33 -27.22 60.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.684 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.479 ' N ' ' OE1' ' A' ' 56' ' ' GLU . 0.5 OUTLIER 57.24 148.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.695 -179.879 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.479 ' SG ' ' O ' ' A' ' 85' ' ' SER . 28.0 p 175.78 121.13 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.958 0.408 . . . . 0.0 111.348 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.4 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 0.0 OUTLIER -96.89 57.07 1.49 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.619 179.684 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.583 ' O ' HG12 ' A' ' 61' ' ' VAL . 32.5 t -76.51 49.92 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.975 0.416 . . . . 0.0 111.478 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.712 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 40.23 114.49 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.661 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.753 ' N ' ' O ' ' A' ' 81' ' ' ALA . 13.1 tttm -56.08 -37.1 68.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.52 0.676 . . . . 0.0 109.179 178.012 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.648 ' O ' ' N ' ' A' ' 80' ' ' THR . 70.7 m -143.71 117.51 9.31 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.379 179.368 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.751 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 2.5 p90 -106.35 162.4 13.71 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.245 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.847 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -132.95 27.82 4.22 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 107.613 -1.255 . . . . 0.0 107.613 176.67 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.682 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.2 OUTLIER -6.64 129.69 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 112.201 -2.272 . . . . 0.0 112.522 -179.424 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 1.084 HG21 ' CD1' ' A' ' 25' ' ' ILE . 4.9 m -138.76 53.31 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 114.585 -1.188 . . . . 0.0 110.302 179.573 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.657 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 17.7 m -24.91 118.22 0.05 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.182 0.515 . . . . 0.0 111.466 -178.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 1.023 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -109.82 -171.21 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.283 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.622 ' HG2' ' CZ ' ' A' ' 17' ' ' PHE . 3.0 mtp 30.23 -149.68 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.51 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.478 ' H ' ' HB3' ' A' ' 71' ' ' MET . . . -46.76 -20.39 0.65 Allowed Glycine 0 N--CA 1.438 -1.181 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.822 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.64 ' C ' HG23 ' A' ' 69' ' ' THR . . . 152.78 32.41 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.665 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.657 ' O ' ' HA ' ' A' ' 69' ' ' THR . 9.1 m-30 -53.09 179.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.53 0.205 . . . . 0.0 110.81 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.569 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -155.0 103.4 2.39 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.883 0.373 . . . . 0.0 111.184 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.198 HG21 ' CG2' ' A' ' 25' ' ' ILE . 27.4 m -100.49 10.94 7.19 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.034 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.751 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 27.87 40.35 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 105.384 -2.08 . . . . 0.0 105.384 -177.092 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.929 ' HB2' HG13 ' A' ' 68' ' ' VAL . 48.0 t30 3.26 64.58 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 113.253 -1.794 . . . . 0.0 108.593 -174.022 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 1.055 ' O ' HD21 ' A' ' 12' ' ' LEU . 37.8 m170 -38.07 120.4 0.86 Allowed 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 112.779 -2.01 . . . . 0.0 113.154 -176.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.648 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.0 OUTLIER -110.19 -7.52 14.86 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 113.533 -1.667 . . . . 0.0 109.466 179.455 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.753 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -173.76 142.2 0.89 Allowed 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.253 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.658 ' SG ' HD12 ' A' ' 12' ' ' LEU . 3.2 m -115.93 163.13 16.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.305 0.574 . . . . 0.0 111.457 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.519 ' O ' ' CG ' ' A' ' 83' ' ' HIS . 26.4 p-80 -165.58 107.27 0.77 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.128 179.034 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.467 ' O ' ' CB ' ' A' ' 85' ' ' SER . 0.9 OUTLIER -88.2 115.93 26.04 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.729 -179.72 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.514 ' O ' ' C ' ' A' ' 86' ' ' THR . 0.0 OUTLIER 163.44 151.25 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.173 179.98 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.514 ' C ' ' O ' ' A' ' 85' ' ' SER . 17.9 m -24.45 103.92 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.274 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.485 ' SG ' ' CG2' ' A' ' 61' ' ' VAL . 53.2 m -59.96 138.15 57.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.086 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.454 ' O ' ' HB2' ' A' ' 89' ' ' TYR . 45.8 t80 59.31 76.05 0.37 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.074 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.454 ' HB2' ' O ' ' A' ' 88' ' ' TYR . 49.9 t80 176.85 73.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.005 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -71.76 113.45 8.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.01 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.44 59.54 1.09 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.615 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.936 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 0.777 ' H82' HD11 ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.481 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 180' ' ' BMA . . . . . 0.672 ' O2 ' ' C5 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 181' ' ' MAN . . . . . 0.672 ' C5 ' ' O2 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 182' ' ' MAN . . . . . 0.646 ' H62' ' H82' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 183' ' ' NAG . . . . . 0.646 ' H82' ' H62' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.472 ' C6 ' ' O5 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 185' ' ' GAL . . . . . 0.472 ' O5 ' ' C6 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.439 ' HB1' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.949 0.404 . . . . 0.0 110.97 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.439 ' HD2' ' HB1' ' A' ' 1' ' ' ALA . 63.7 Cg_exo -52.03 -66.44 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.696 2.264 . . . . 0.0 112.234 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.491 ' OD1' ' N ' ' A' ' 3' ' ' ASP . 9.5 p-10 -61.42 143.77 55.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.79 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.0 m -142.57 123.81 11.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.292 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -129.19 133.57 47.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.792 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 172.62 34.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.114 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 55.75 58.67 9.88 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.182 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.67 71.22 4.04 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.755 2.303 . . . . 0.0 111.782 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 63.53 121.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.538 -179.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.591 ' CB ' ' O ' ' A' ' 31' ' ' CYS . 43.5 t -51.78 159.3 0.84 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.456 0.646 . . . . 0.0 111.524 -179.3 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.716 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 0.6 OUTLIER -179.28 -160.71 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.709 179.746 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.793 HD21 ' CB ' ' A' ' 79' ' ' HIS . 10.8 mp -90.2 128.37 36.35 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.164 0.507 . . . . 0.0 111.59 -179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.619 ' O ' ' C ' ' A' ' 14' ' ' GLU . 5.0 mt-30 -96.52 46.96 1.06 Allowed 'General case' 0 CA--C 1.502 -0.867 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.775 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.79 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -0.29 117.1 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 113.775 -1.557 . . . . 0.0 110.797 -179.138 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.778 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.7 OUTLIER -54.88 101.96 0.28 Allowed Pre-proline 0 C--N 1.31 -1.119 0 CA-C-N 114.552 -1.204 . . . . 0.0 112.413 -178.637 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.592 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 61.8 Cg_endo -73.67 7.41 2.34 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 122.091 1.861 . . . . 0.0 110.003 177.736 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.54 ' HB3' ' OD1' ' A' ' 15' ' ' ASN . 1.5 t80 -102.81 -60.7 1.5 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.191 -1.368 . . . . 0.0 110.102 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.925 ' HD2' HG21 ' A' ' 25' ' ' ILE . 3.2 m-85 -82.93 3.76 28.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.459 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.833 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 15.0 t -64.07 99.11 0.24 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.558 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.627 ' N ' ' O ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -102.26 170.33 6.5 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.991 179.046 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.542 ' HA ' ' O2 ' ' A' ' 186' ' ' GAL . 14.7 Cg_endo -57.45 73.12 0.04 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 122.454 2.103 . . . . 0.0 111.94 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.535 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 133.79 -9.61 4.89 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.359 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 1.143 ' CB ' ' H83' ' A' ' 178' ' ' NAG . . . -146.12 104.0 4.11 Favored Pre-proline 0 CA--C 1.509 -0.6 0 CA-C-O 121.81 0.815 . . . . 0.0 111.247 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.864 ' O ' ' O ' ' A' ' 25' ' ' ILE . 78.3 Cg_endo -97.06 25.39 0.25 Allowed 'Trans proline' 0 N--CA 1.449 -1.133 0 C-N-CA 124.46 3.44 . . . . 0.0 113.477 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.176 ' CG2' HG21 ' A' ' 76' ' ' VAL . 10.7 mm 21.94 -175.03 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 114.932 -1.031 . . . . 0.0 112.843 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.968 ' H ' HG22 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -158.76 -166.08 1.79 Allowed 'General case' 0 CA--C 1.498 -1.043 0 N-CA-C 115.656 1.725 . . . . 0.0 115.656 -174.743 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.558 ' O ' ' CG ' ' A' ' 27' ' ' GLN . 0.5 OUTLIER 166.54 66.99 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 111.561 -2.563 . . . . 0.0 110.75 179.642 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.797 ' HB2' ' HD1' ' A' ' 79' ' ' HIS . 0.1 OUTLIER -19.1 116.07 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.485 -0.779 . . . . 0.0 112.117 -179.089 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.555 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.2 OUTLIER -147.39 123.06 10.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.275 179.271 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.564 ' HA3' ' HA ' ' A' ' 10' ' ' CYS . . . 169.31 -136.51 4.08 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.974 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.591 ' O ' ' CB ' ' A' ' 10' ' ' CYS . 95.0 m -126.8 163.35 23.76 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.778 0.323 . . . . 0.0 111.075 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.511 ' C ' ' CD1' ' A' ' 33' ' ' PHE . 4.9 m -139.19 142.02 37.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.997 0.427 . . . . 0.0 111.476 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.518 ' CD1' ' N ' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -135.93 -172.84 3.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.383 179.239 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 6.7 t -76.6 -69.07 0.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.795 0.331 . . . . 0.0 110.604 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.516 ' CG ' ' N ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 54.08 168.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.384 179.594 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.516 ' N ' ' CG ' ' A' ' 35' ' ' ARG . . . 37.64 88.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.83 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.657 ' HB3' ' HD3' ' A' ' 38' ' ' PRO . 0.6 OUTLIER -118.13 -53.44 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.874 179.29 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.668 ' O ' HG23 ' A' ' 39' ' ' THR . 23.3 Cg_exo -63.96 176.74 2.26 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.505 2.137 . . . . 0.0 111.951 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.668 HG23 ' O ' ' A' ' 38' ' ' PRO . 0.1 OUTLIER 176.82 169.06 0.42 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 120.91 0.386 . . . . 0.0 111.201 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.523 ' HD2' ' CB ' ' A' ' 39' ' ' THR . 17.6 Cg_endo -57.69 76.08 0.04 OUTLIER 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.92 2.413 . . . . 0.0 112.355 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.472 ' O ' ' HB2' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -172.13 60.65 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.578 179.888 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.472 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 0.9 OUTLIER 70.99 142.04 0.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.974 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.1 t -154.05 -123.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.638 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.548 ' O ' ' O ' ' A' ' 45' ' ' LYS . 2.2 mmtp 59.74 -177.97 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.052 0.453 . . . . 0.0 111.701 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.548 ' O ' ' O ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER 0.69 121.77 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.215 -0.902 . . . . 0.0 112.86 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.466 ' O ' ' CB ' ' A' ' 47' ' ' MET . 1.8 t -114.17 156.23 24.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.306 179.076 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.466 ' CB ' ' O ' ' A' ' 46' ' ' THR . 0.0 OUTLIER 161.78 97.88 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.708 -179.764 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.439 HD12 ' H ' ' A' ' 47' ' ' MET . 5.1 mp -146.71 143.52 28.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.932 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.446 ' H ' HG23 ' A' ' 49' ' ' VAL . 1.5 t -56.03 118.82 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.973 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.487 ' CG ' ' O ' ' A' ' 50' ' ' GLN . 0.4 OUTLIER -88.78 36.32 0.8 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.648 179.751 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -86.05 -159.07 0.44 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.743 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.485 ' O ' ' O ' ' A' ' 53' ' ' VAL . 0.0 OUTLIER 49.82 36.79 11.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.171 179.615 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.808 HG23 ' N ' ' A' ' 54' ' ' THR . 1.0 OUTLIER 36.29 -160.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.226 179.849 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.808 ' N ' HG23 ' A' ' 53' ' ' VAL . 5.4 t 175.72 37.14 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.274 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.438 ' O ' ' OG ' ' A' ' 55' ' ' SER . 8.3 p -133.86 87.81 2.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.89 0.376 . . . . 0.0 111.058 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.512 ' O ' ' OG ' ' A' ' 57' ' ' SER . 15.0 tt0 -84.59 -84.69 0.14 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.107 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.512 ' OG ' ' O ' ' A' ' 56' ' ' GLU . 1.2 m -173.23 101.9 0.12 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.868 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -133.82 156.45 48.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.923 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.495 ' O ' ' SG ' ' A' ' 87' ' ' CYS . 0.7 OUTLIER -179.37 126.4 0.09 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.156 179.91 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.442 ' C ' ' O ' ' A' ' 59' ' ' CYS . 0.1 OUTLIER -34.22 137.79 0.1 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.091 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.642 HG23 ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -150.15 71.47 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.52 179.779 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.587 ' HA ' ' O ' ' A' ' 81' ' ' ALA . . . 4.2 101.5 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.745 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.786 ' N ' ' O ' ' A' ' 81' ' ' ALA . 0.1 OUTLIER -54.4 -33.48 59.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.502 0.668 . . . . 0.0 109.749 178.291 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.48 ' O ' ' N ' ' A' ' 80' ' ' THR . 17.2 m -151.46 125.88 9.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.843 -1.072 . . . . 0.0 109.744 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.898 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.3 OUTLIER -106.33 163.94 12.43 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.278 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.781 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.9 OUTLIER -130.34 27.45 5.05 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 177.243 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.706 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 3.9 ptt-85 -12.39 99.81 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 112.515 -2.13 . . . . 0.0 111.623 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 1.013 HG13 ' HB2' ' A' ' 78' ' ' ASN . 8.2 m -97.61 45.9 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 CA-C-N 114.683 -1.144 . . . . 0.0 109.837 179.174 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.62 ' C ' ' O ' ' A' ' 68' ' ' VAL . 28.8 m -14.65 117.58 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.969 -178.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.775 HG21 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -114.06 -162.43 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 121.768 0.794 . . . . 0.0 111.996 -179.604 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.635 ' O ' ' CD2' ' A' ' 74' ' ' PHE . 9.2 mtm -21.25 143.17 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 113.855 -1.52 . . . . 0.0 112.716 -178.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 43.62 20.86 0.15 Allowed Glycine 0 N--CA 1.444 -0.791 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.768 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.467 ' O ' ' O ' ' A' ' 74' ' ' PHE . . . 81.55 27.94 45.42 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.055 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.635 ' CD2' ' O ' ' A' ' 71' ' ' MET . 38.5 m-85 -50.45 -174.51 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.69 0.281 . . . . 0.0 110.337 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.8 mttt -167.66 104.76 0.51 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.029 0.442 . . . . 0.0 112.057 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.176 HG21 ' CG2' ' A' ' 25' ' ' ILE . 16.8 m -98.13 14.8 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.36 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.392 178.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.898 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.8 OUTLIER 30.77 38.31 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 105.288 -2.115 . . . . 0.0 105.288 -176.869 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 1.013 ' HB2' HG13 ' A' ' 68' ' ' VAL . 30.4 t30 -2.52 66.88 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.974 0 CA-C-N 112.776 -2.011 . . . . 0.0 108.858 -174.352 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.818 ' O ' HD13 ' A' ' 26' ' ' LEU . 36.1 m170 -34.12 120.84 0.45 Allowed 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 113.349 -1.75 . . . . 0.0 112.405 -177.277 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.48 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.9 p -111.3 -14.25 13.82 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.368 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.786 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -165.08 138.86 4.8 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.1 OUTLIER -120.47 145.88 46.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.072 0.463 . . . . 0.0 111.5 -179.142 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.642 ' O ' HG23 ' A' ' 61' ' ' VAL . 3.7 p-80 -149.88 116.11 5.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.774 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 5.7 m -61.4 125.04 22.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.7 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.475 ' O ' ' SG ' ' A' ' 87' ' ' CYS . 8.0 m -162.3 -154.83 0.34 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.93 0.395 . . . . 0.0 111.081 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.461 ' C ' ' SG ' ' A' ' 87' ' ' CYS . 15.2 m -65.61 138.96 58.37 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.92 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.495 ' SG ' ' O ' ' A' ' 59' ' ' CYS . 0.1 OUTLIER -177.82 -179.61 0.8 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.726 179.891 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -45.06 123.92 4.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.989 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 30.6 t80 -99.52 -67.76 0.84 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.54 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -177.04 17.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.112 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.431 ' O ' ' CB ' ' A' ' 92' ' ' SER . 0.0 OUTLIER -166.43 9.48 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.444 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.431 ' CB ' ' O ' ' A' ' 91' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.321 -0.847 . . . . 0.0 111.064 179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 1.143 ' H83' ' CB ' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.518 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 183' ' ' NAG . . . . . 0.441 ' H3 ' ' O7 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.578 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 185' ' ' GAL . . . . . 0.578 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 186' ' ' GAL . . . . . 0.542 ' O2 ' ' HA ' ' A' ' 21' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.825 0.345 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -63.15 167.44 12.54 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.917 2.411 . . . . 0.0 112.14 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -142.31 -40.02 0.35 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.917 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.8 HG13 ' HG2' ' A' ' 5' ' ' GLN . 0.3 OUTLIER -125.79 138.86 53.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.907 179.952 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.8 ' HG2' HG13 ' A' ' 4' ' ' VAL . 10.2 mm100 69.92 -166.52 0.17 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.018 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.443 ' C ' ' O ' ' A' ' 5' ' ' GLN . 70.3 m-20 35.53 71.0 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.575 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -131.05 127.47 22.01 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.861 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.436 ' O ' ' SG ' ' A' ' 31' ' ' CYS . 60.6 Cg_endo -73.44 167.22 27.84 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 122.572 2.181 . . . . 0.0 112.135 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.447 ' HA ' ' HE1' ' A' ' 33' ' ' PHE . 1.8 tt0 -63.97 160.03 18.69 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.294 0.569 . . . . 0.0 111.144 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.526 ' HA ' ' HA3' ' A' ' 30' ' ' GLY . 1.0 OUTLIER -91.05 112.39 24.28 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.842 -179.954 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.573 ' O ' ' N ' ' A' ' 29' ' ' MET . 11.7 t -177.9 -177.42 0.63 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.246 0.546 . . . . 0.0 111.041 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.169 HD21 ' O ' ' A' ' 79' ' ' HIS . 4.9 mp -64.04 131.28 47.12 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.716 -179.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.669 ' O ' ' O ' ' A' ' 14' ' ' GLU . 2.1 mt-30 -114.35 59.1 0.68 Allowed 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.253 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.669 ' O ' ' O ' ' A' ' 13' ' ' GLN . 31.5 tt0 4.56 125.26 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.327 -1.761 . . . . 0.0 112.231 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.763 ' OD1' HG11 ' A' ' 76' ' ' VAL . 0.2 OUTLIER -51.8 123.19 24.04 Favored Pre-proline 0 C--N 1.314 -0.937 0 CA-C-N 114.407 -1.269 . . . . 0.0 111.769 179.978 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.464 ' HD2' ' ND2' ' A' ' 15' ' ' ASN . 84.0 Cg_endo -83.31 20.44 1.17 Allowed 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 122.692 2.261 . . . . 0.0 111.559 179.091 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.615 ' CD1' ' HB ' ' A' ' 70' ' ' VAL . 29.9 t80 -133.2 -52.55 0.9 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.449 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 1.095 ' CD1' HG12 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -77.2 -10.78 59.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.964 -179.647 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.587 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -61.82 83.64 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.002 0.429 . . . . 0.0 110.682 -179.789 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.639 ' HB3' ' HD2' ' A' ' 21' ' ' PRO . 1.1 mt-30 -110.83 164.76 14.1 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.696 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.639 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 27.3 Cg_endo -61.62 61.33 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.574 2.183 . . . . 0.0 111.544 179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 157.41 -15.31 0.32 Allowed Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.469 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 1.03 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -148.71 104.86 3.44 Favored Pre-proline 0 CA--C 1.514 -0.415 0 CA-C-O 121.905 0.86 . . . . 0.0 111.654 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.652 ' O ' ' O ' ' A' ' 25' ' ' ILE . 92.3 Cg_endo -105.37 67.39 0.02 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.455 0 C-N-CA 124.756 3.637 . . . . 0.0 113.379 -178.403 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.322 ' CG2' HG21 ' A' ' 76' ' ' VAL . 29.8 mm -41.87 -173.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.032 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.753 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.058 HD11 ' OD1' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -151.51 -157.72 0.84 Allowed 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -175.192 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.529 ' O ' ' CG ' ' A' ' 27' ' ' GLN . 3.8 tt0 169.44 66.12 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 112.895 -1.957 . . . . 0.0 111.321 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.662 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 17.0 t -23.78 99.35 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.7 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.573 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.3 OUTLIER -137.14 145.45 43.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.061 -179.654 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.526 ' HA3' ' HA ' ' A' ' 10' ' ' CYS . . . 162.47 -127.08 1.65 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.569 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.436 ' SG ' ' O ' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -154.57 133.49 12.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.89 0.376 . . . . 0.0 110.732 -179.84 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.53 ' O ' ' HB3' ' A' ' 33' ' ' PHE . 98.2 m -71.79 108.83 5.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.572 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.556 ' C ' ' CD1' ' A' ' 33' ' ' PHE . 0.0 OUTLIER 173.98 9.11 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.324 179.504 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.425 ' O ' ' O ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -45.71 124.4 5.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.84 0.352 . . . . 0.0 110.78 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.45 ' HD2' ' HA ' ' A' ' 35' ' ' ARG . 0.5 OUTLIER 58.17 151.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.711 -179.666 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.439 ' O ' ' O ' ' A' ' 35' ' ' ARG . . . 40.35 96.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.18 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.6 p90 -84.29 121.48 75.31 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 120.93 0.395 . . . . 0.0 110.638 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.52 ' O ' ' HD3' ' A' ' 40' ' ' PRO . 74.7 Cg_exo -48.26 -178.42 0.01 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.79 2.326 . . . . 0.0 112.126 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.603 ' HB ' HD11 ' A' ' 41' ' ' LEU . 18.4 p -104.66 80.63 0.48 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.807 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.52 ' HD3' ' O ' ' A' ' 38' ' ' PRO . 50.3 Cg_exo -40.46 -73.44 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.859 2.372 . . . . 0.0 112.409 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.603 HD11 ' HB ' ' A' ' 39' ' ' THR . 0.1 OUTLIER 32.21 54.32 0.32 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.059 -179.848 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.563 ' O ' ' CB ' ' A' ' 43' ' ' SER . 0.4 OUTLIER 73.0 127.86 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.702 -179.826 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.563 ' CB ' ' O ' ' A' ' 42' ' ' ARG . 3.4 t 87.98 135.75 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.653 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.2 mtpt -102.49 47.59 0.89 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.363 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.06 152.71 3.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.642 179.716 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.61 HG21 ' OE1' ' A' ' 50' ' ' GLN . 0.2 OUTLIER -50.01 150.99 2.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.72 179.922 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -84.3 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.176 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.534 ' H ' ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -58.2 -179.2 0.05 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.834 0.35 . . . . 0.0 110.861 -179.825 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.5 p -93.2 130.8 41.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.075 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.61 ' OE1' HG21 ' A' ' 46' ' ' THR . 0.0 OUTLIER 177.9 48.16 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.652 -179.78 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.447 ' C ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER 31.01 94.78 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.32 -179.908 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.436 ' C ' ' O ' ' A' ' 51' ' ' LYS . 5.5 p30 -33.35 133.62 0.15 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.948 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.41 HG22 ' N ' ' A' ' 54' ' ' THR . 12.1 p -139.09 155.28 26.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.242 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.41 ' N ' HG22 ' A' ' 53' ' ' VAL . 0.2 OUTLIER 48.48 47.09 20.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.949 179.797 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.0 m 46.85 -93.99 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.521 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.424 ' O ' ' CB ' ' A' ' 57' ' ' SER . 0.0 OUTLIER -91.09 -94.96 0.12 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.442 -179.285 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.479 ' OG ' ' N ' ' A' ' 58' ' ' THR . 2.0 p 77.17 -149.11 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.564 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.546 ' O ' ' CB ' ' A' ' 59' ' ' CYS . 0.2 OUTLIER 58.07 172.26 0.05 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.856 -179.885 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.546 ' CB ' ' O ' ' A' ' 58' ' ' THR . 0.7 OUTLIER 156.07 133.94 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.904 179.836 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 90.3 m -73.25 65.5 0.84 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.715 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.572 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -91.87 73.63 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.877 0.37 . . . . 0.0 111.358 -179.832 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.795 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 11.67 116.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.345 -0.843 . . . . 0.0 113.096 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.682 ' N ' ' O ' ' A' ' 81' ' ' ALA . 6.0 ttmm -54.53 -38.56 66.7 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 177.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.604 ' HB2' ' HB3' ' A' ' 81' ' ' ALA . 2.9 m -134.38 166.38 22.97 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.364 -1.289 . . . . 0.0 108.815 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.756 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.5 OUTLIER -151.4 159.28 44.32 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.165 -0.614 . . . . 0.0 112.491 -179.285 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.974 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -128.65 28.07 5.44 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 122.554 1.169 . . . . 0.0 107.903 176.798 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.612 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.5 OUTLIER -4.95 130.67 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 112.174 -2.285 . . . . 0.0 113.09 -179.496 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.943 HG11 ' CD1' ' A' ' 25' ' ' ILE . 1.6 m -144.57 46.79 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.243 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.796 HG23 ' C ' ' A' ' 73' ' ' GLY . 16.9 m -12.05 122.33 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.75 -1.113 . . . . 0.0 111.649 -179.772 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 1.095 HG12 ' CD1' ' A' ' 18' ' ' PHE . 3.7 m -119.03 -169.1 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.946 0.879 . . . . 0.0 112.759 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.758 ' HG2' HG23 ' A' ' 70' ' ' VAL . 0.4 OUTLIER 21.34 -120.57 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.02 -1.445 . . . . 0.0 112.529 179.917 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.405 ' H ' ' CG ' ' A' ' 71' ' ' MET . . . -70.75 31.66 0.49 Allowed Glycine 0 CA--C 1.518 0.231 0 CA-C-N 115.986 -0.552 . . . . 0.0 113.504 -178.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.796 ' C ' HG23 ' A' ' 69' ' ' THR . . . 90.85 22.1 34.34 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.685 -0.769 . . . . 0.0 111.756 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.786 ' HB2' HG22 ' A' ' 70' ' ' VAL . 0.6 OUTLIER -45.7 -178.95 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.091 0.472 . . . . 0.0 111.374 -179.887 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.558 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -154.66 82.33 1.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.369 179.543 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.322 HG21 ' CG2' ' A' ' 25' ' ' ILE . 27.2 m -78.38 12.25 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.493 -1.241 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.229 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.838 ' CG ' ' HE2' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 24.07 44.58 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 -178.364 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 1.058 ' OD1' HD11 ' A' ' 26' ' ' LEU . 31.3 t-20 6.36 63.36 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 -174.367 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 1.169 ' O ' HD21 ' A' ' 12' ' ' LEU . 32.2 m170 -37.98 108.79 0.09 Allowed 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.433 -176.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.559 HG23 ' O ' ' A' ' 78' ' ' ASN . 4.7 p -104.48 -5.14 21.89 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.012 -1.449 . . . . 0.0 110.702 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.682 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -162.06 144.32 11.33 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 179.082 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.591 ' SG ' ' CD1' ' A' ' 12' ' ' LEU . 84.5 m -121.13 157.56 29.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.062 0.458 . . . . 0.0 111.718 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.474 ' HB3' ' O ' ' A' ' 82' ' ' CYS . 2.0 p-80 176.39 118.12 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.377 179.628 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 34.5 m -51.57 131.48 29.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.413 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.518 ' O ' ' HB2' ' A' ' 59' ' ' CYS . 0.2 OUTLIER -171.77 145.93 2.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.507 179.738 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.498 ' C ' ' O ' ' A' ' 85' ' ' SER . 0.8 OUTLIER -29.16 142.99 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.009 -179.711 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.494 ' O ' ' C ' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -95.54 130.13 42.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.16 -179.688 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.593 ' O ' ' C ' ' A' ' 89' ' ' TYR . 0.1 OUTLIER -29.0 115.18 0.09 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.867 179.724 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.593 ' C ' ' O ' ' A' ' 88' ' ' TYR . 2.6 m-85 -12.51 -73.83 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.538 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.565 ' CB ' ' O ' ' A' ' 89' ' ' TYR . 0.2 OUTLIER 153.36 140.64 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.731 179.819 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -47.47 169.96 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.875 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.837 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 1.086 ' H82' HD11 ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.763 ' O7 ' ' C3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.662 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 185' ' ' GAL . . . . . 0.662 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.462 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.763 0.316 . . . . 0.0 110.954 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 1' ' ' ALA . 6.3 Cg_exo -77.26 -155.25 0.05 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 123.008 2.472 . . . . 0.0 112.304 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.28 111.67 3.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.868 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.0 m -90.86 168.12 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.132 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -148.83 177.52 9.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.762 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.561 ' OD1' ' N ' ' A' ' 6' ' ' ASP . 3.1 p-10 -129.66 -176.18 3.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.078 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.505 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.1 OUTLIER -25.53 103.13 0.12 Allowed Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.402 -179.925 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.44 ' O ' ' C ' ' A' ' 9' ' ' GLU . 72.6 Cg_endo -78.39 143.78 19.82 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.732 2.288 . . . . 0.0 112.104 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.526 ' O ' ' CG2' ' A' ' 11' ' ' THR . 0.0 OUTLIER -34.76 115.93 0.3 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.882 0.373 . . . . 0.0 110.626 179.876 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.466 ' O ' HG22 ' A' ' 11' ' ' THR . 7.2 t -49.94 136.87 17.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.204 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.846 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -161.96 -137.01 0.03 OUTLIER 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.973 179.325 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.168 HD21 ' O ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER -111.5 129.53 56.02 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.156 179.226 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.629 ' HG3' ' HB2' ' A' ' 29' ' ' MET . 0.1 OUTLIER -103.01 48.15 0.86 Allowed 'General case' 0 CA--C 1.502 -0.899 0 CA-C-O 121.713 0.768 . . . . 0.0 110.846 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.611 ' C ' ' O ' ' A' ' 13' ' ' GLN . 39.4 tt0 -7.12 120.69 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.52 -1.673 . . . . 0.0 110.619 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.727 ' CB ' ' HB ' ' A' ' 25' ' ' ILE . 0.4 OUTLIER -54.46 98.95 0.19 Allowed Pre-proline 0 C--N 1.306 -1.318 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.98 -178.904 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.572 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 2.8 Cg_exo -73.84 6.0 3.12 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.464 2.109 . . . . 0.0 109.224 177.809 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.488 ' H ' ' C ' ' A' ' 15' ' ' ASN . 1.0 OUTLIER -101.27 -54.3 2.81 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 113.671 -1.604 . . . . 0.0 110.398 -179.673 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.885 ' CD2' HG21 ' A' ' 70' ' ' VAL . 0.4 OUTLIER -86.97 -21.77 25.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.879 -179.714 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.724 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 28.2 t -37.9 107.53 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.758 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.812 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -115.0 171.29 4.59 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.945 -179.692 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -65.63 70.29 0.34 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.855 2.37 . . . . 0.0 111.601 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 135.29 -5.79 4.24 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.197 -179.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 1.007 ' CB ' ' H83' ' A' ' 178' ' ' NAG . . . -151.37 102.72 2.93 Favored Pre-proline 0 CA--C 1.513 -0.459 0 CA-C-O 122.037 0.922 . . . . 0.0 111.526 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.724 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 88.6 Cg_endo -103.0 80.02 0.03 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.529 0 C-N-CA 124.788 3.659 . . . . 0.0 113.131 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.224 ' CG2' HG21 ' A' ' 76' ' ' VAL . 15.1 mm -40.8 -177.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.97 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.634 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.08 HD13 HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -152.04 -160.82 1.2 Allowed 'General case' 0 CA--C 1.498 -1.057 0 CA-C-O 122.681 1.229 . . . . 0.0 114.237 -175.624 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.527 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 4.7 tt0 159.98 62.21 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 112.348 -2.206 . . . . 0.0 110.324 179.776 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.753 ' SG ' ' HB3' ' A' ' 79' ' ' HIS . 75.9 m -23.35 118.69 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.275 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.629 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -150.1 130.07 13.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.003 0.43 . . . . 0.0 111.389 179.767 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 170.42 -112.88 0.48 Allowed Glycine 0 N--CA 1.452 -0.265 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.099 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -162.14 153.84 18.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.683 0.278 . . . . 0.0 110.589 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.511 ' HB2' ' HB3' ' A' ' 84' ' ' CYS . 6.1 t -114.55 80.64 1.43 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.874 0.369 . . . . 0.0 111.248 -179.588 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -117.07 -5.78 11.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.532 179.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 56.8 m -103.07 -164.9 1.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.705 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.526 ' NH2' ' O ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -176.97 44.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.252 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.41 ' C ' ' O ' ' A' ' 35' ' ' ARG . . . -38.23 92.66 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.68 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.556 ' HB3' ' HD3' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -89.6 -59.73 0.24 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.204 -179.633 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.556 ' HD3' ' HB3' ' A' ' 37' ' ' TYR . 83.1 Cg_endo -89.75 174.31 3.4 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.036 2.491 . . . . 0.0 112.875 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.618 ' OG1' ' HD2' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -121.72 163.08 33.21 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.312 179.687 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.618 ' HD2' ' OG1' ' A' ' 39' ' ' THR . 60.2 Cg_endo -82.93 53.3 4.33 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.498 2.132 . . . . 0.0 112.276 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.528 ' O ' ' HB3' ' A' ' 42' ' ' ARG . 5.2 mt -149.05 125.43 10.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.624 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.528 ' HB3' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER 70.34 -83.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.941 -179.736 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.89 43.81 0.61 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.945 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.78 93.44 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.958 0.408 . . . . 0.0 110.514 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.426 ' NZ ' ' HB3' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -169.35 151.48 4.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.725 -179.708 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 61.5 p -143.8 82.78 1.73 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.9 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.02 5.3 7.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.072 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.682 ' C ' HD22 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -81.32 76.26 8.26 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.94 0.4 . . . . 0.0 110.746 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.805 HG23 ' HG2' ' A' ' 50' ' ' GLN . 4.4 m -91.0 -151.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.192 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.805 ' HG2' HG23 ' A' ' 49' ' ' VAL . 0.8 OUTLIER 37.68 84.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.521 ' O ' ' CG ' ' A' ' 51' ' ' LYS . 37.1 tttt 166.5 53.96 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.573 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -175.26 118.39 0.17 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.115 -179.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 9.9 p -122.01 154.79 26.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.052 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.6 p -107.25 100.74 10.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.7 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.06 11.58 16.46 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.63 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 54.19 59.57 4.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.727 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.463 ' C ' ' OG1' ' A' ' 58' ' ' THR . 0.5 OUTLIER -139.31 -163.95 1.58 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.725 -179.841 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.491 HG22 ' CA ' ' A' ' 85' ' ' SER . 0.0 OUTLIER 63.44 164.35 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.989 179.935 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 17.3 p -162.4 142.0 9.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 65.6 m -81.66 102.31 10.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.7 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.515 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.1 OUTLIER -116.82 49.72 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 121.154 0.502 . . . . 0.0 111.288 -179.961 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.771 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 44.15 112.85 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.528 179.2 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.673 ' HB3' ' CB ' ' A' ' 81' ' ' ALA . 19.5 ttmt -56.12 -36.69 68.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.589 0.709 . . . . 0.0 109.243 178.053 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.552 ' O ' ' N ' ' A' ' 80' ' ' THR . 18.5 m -147.09 135.17 21.5 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.752 -1.113 . . . . 0.0 108.62 179.249 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.726 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.3 OUTLIER -119.29 155.27 32.11 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.235 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.95 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -128.91 26.71 5.51 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 176.289 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.692 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.5 OUTLIER -4.91 127.62 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 112.58 -2.1 . . . . 0.0 111.769 -179.529 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.98 HG21 ' CD1' ' A' ' 25' ' ' ILE . 2.4 m -128.09 42.43 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.837 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.673 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 73.4 m -19.04 118.2 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.598 -179.032 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.885 HG21 ' CD2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -129.87 -167.5 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.732 179.741 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.611 ' HG3' ' CD2' ' A' ' 74' ' ' PHE . 0.2 OUTLIER 37.04 -137.94 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.342 -179.701 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -80.35 30.63 2.44 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.308 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.66 47.09 0.99 Allowed Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.336 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.673 ' O ' ' HA ' ' A' ' 69' ' ' THR . 9.2 m-30 -90.47 113.42 25.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.844 0.354 . . . . 0.0 110.904 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.597 ' HB3' ' OE1' ' A' ' 77' ' ' GLU . 1.9 mmmm -99.44 107.61 19.87 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.129 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.224 HG21 ' CG2' ' A' ' 25' ' ' ILE . 11.8 m -97.24 15.84 2.98 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.499 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.43 178.648 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.726 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 25.03 41.97 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.132 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -177.344 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.991 ' C ' HD12 ' A' ' 26' ' ' LEU . 10.9 t-20 9.19 65.58 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.998 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 -175.725 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 1.168 ' O ' HD21 ' A' ' 12' ' ' LEU . 25.6 m170 -42.27 89.73 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 122.455 1.122 . . . . 0.0 111.977 -175.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.716 HG22 ' OD1' ' A' ' 78' ' ' ASN . 4.2 p -79.88 -1.33 38.68 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 113.712 -1.585 . . . . 0.0 110.408 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.673 ' CB ' ' HB3' ' A' ' 63' ' ' LYS . . . -177.17 147.05 0.53 Allowed 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.203 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.826 ' SG ' HD12 ' A' ' 12' ' ' LEU . 2.7 m -116.15 164.94 13.74 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.875 0.369 . . . . 0.0 111.178 -179.279 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.48 ' O ' ' CG ' ' A' ' 83' ' ' HIS . 6.5 p-80 178.85 122.05 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.941 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.511 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 28.7 p -76.26 123.86 26.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.993 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.491 ' CA ' HG22 ' A' ' 58' ' ' THR . 4.4 t -147.71 135.91 21.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.17 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.417 ' HA ' ' HA ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -54.66 113.35 1.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.781 179.889 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.419 ' O ' ' C ' ' A' ' 88' ' ' TYR . 5.1 p -114.26 138.71 50.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.808 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.631 ' CD1' ' N ' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -34.03 146.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.043 179.947 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -157.28 76.25 0.83 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.978 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 29.0 m80 -147.75 171.14 16.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.476 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.412 ' C ' ' OG ' ' A' ' 92' ' ' SER . 2.5 mmtp -116.02 -160.9 0.77 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.859 0.361 . . . . 0.0 111.076 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.412 ' OG ' ' C ' ' A' ' 91' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.2 -0.905 . . . . 0.0 111.002 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 1.007 ' H83' ' CB ' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.568 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 180' ' ' BMA . . . . . 0.428 ' H62' ' H2 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 182' ' ' MAN . . . . . 0.428 ' H2 ' ' H62' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.598 ' O7 ' ' O3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.57 ' HB3' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.877 0.37 . . . . 0.0 111.003 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.57 ' HD3' ' HB3' ' A' ' 1' ' ' ALA . 18.6 Cg_endo -60.2 77.13 0.06 OUTLIER 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.711 2.274 . . . . 0.0 111.945 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.425 ' N ' ' O ' ' A' ' 1' ' ' ALA . 0.4 OUTLIER -123.96 120.46 32.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.096 -179.755 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.1 m -131.8 165.94 30.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.04 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.494 ' O ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -161.96 120.4 2.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.804 0.335 . . . . 0.0 111.574 -179.754 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.587 ' O ' ' C ' ' A' ' 7' ' ' CYS . 1.1 m-20 35.43 -161.03 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.352 179.298 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.587 ' C ' ' O ' ' A' ' 6' ' ' ASP . 4.9 t -3.8 89.33 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.296 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.165 -179.567 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.605 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 93.3 Cg_endo -81.96 39.99 0.92 Allowed 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.909 2.406 . . . . 0.0 111.935 179.516 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.703 ' O ' HG22 ' A' ' 11' ' ' THR . 0.0 OUTLIER 95.19 141.91 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.927 -179.723 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.473 ' HA ' ' HA3' ' A' ' 30' ' ' GLY . 0.0 OUTLIER -38.78 137.54 0.63 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.96 180.0 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.703 HG22 ' O ' ' A' ' 9' ' ' GLU . 2.7 t 174.98 -165.57 0.03 OUTLIER 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 120.953 0.406 . . . . 0.0 110.611 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.999 HD23 HD13 ' A' ' 26' ' ' LEU . 6.5 mp -90.12 136.9 32.77 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.042 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.609 ' O ' ' O ' ' A' ' 14' ' ' GLU . 4.9 mt-30 -108.98 55.11 0.64 Allowed 'General case' 0 CA--C 1.503 -0.863 0 CA-C-O 121.739 0.781 . . . . 0.0 110.55 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.609 ' O ' ' O ' ' A' ' 13' ' ' GLN . 26.8 tt0 -1.13 122.12 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 113.419 -1.719 . . . . 0.0 111.203 -179.271 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.752 ' HB2' HG22 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -50.49 98.5 0.18 Allowed Pre-proline 0 C--N 1.304 -1.371 0 CA-C-N 114.154 -1.385 . . . . 0.0 111.904 -179.201 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.52 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 7.0 Cg_exo -71.8 20.45 0.27 Allowed 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 122.373 2.049 . . . . 0.0 109.592 177.74 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.628 ' H ' ' C ' ' A' ' 15' ' ' ASN . 1.5 t80 -125.1 -55.8 1.57 Allowed 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.157 -178.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.729 ' CD2' HG21 ' A' ' 70' ' ' VAL . 2.0 m-30 -83.12 -6.17 59.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.173 -179.531 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.707 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 6.1 t -60.45 83.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.769 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.79 ' O ' ' N ' ' A' ' 22' ' ' GLY . 9.0 mm100 -97.66 145.03 29.01 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.802 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -44.12 69.96 0.01 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.736 2.29 . . . . 0.0 111.459 179.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.79 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 153.06 -20.2 0.75 Allowed Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.126 -179.19 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 1.053 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -150.44 108.64 3.15 Favored Pre-proline 0 CA--C 1.515 -0.382 0 CA-C-O 121.892 0.853 . . . . 0.0 111.519 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.707 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 62.9 Cg_endo -101.74 73.06 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.35 0 C-N-CA 124.705 3.603 . . . . 0.0 113.22 -178.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.161 ' CG2' HG21 ' A' ' 76' ' ' VAL . 6.9 mm -40.63 -176.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 N-CA-C 113.483 0.919 . . . . 0.0 113.483 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.073 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER -150.21 -162.48 1.56 Allowed 'General case' 0 CA--C 1.502 -0.888 0 CA-C-O 122.635 1.207 . . . . 0.0 114.175 -175.692 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.531 ' O ' ' C ' ' A' ' 28' ' ' CYS . 10.6 tt0 164.2 77.67 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 112.661 -2.063 . . . . 0.0 110.903 179.493 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.622 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER -19.21 114.65 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.28 -179.568 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.544 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.8 mtp -154.1 109.25 3.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.799 0.333 . . . . 0.0 111.204 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.473 ' HA3' ' HA ' ' A' ' 10' ' ' CYS . . . -172.53 -146.67 5.48 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.634 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.511 ' N ' ' SG ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -148.51 115.26 6.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.765 0.316 . . . . 0.0 110.862 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -52.66 122.98 10.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.89 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -85.15 164.34 18.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.997 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -113.8 -152.19 0.5 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.778 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.74 35.86 4.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.982 0.42 . . . . 0.0 110.881 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.81 177.47 2.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.069 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.415 ' O ' ' C ' ' A' ' 38' ' ' PRO . 2.1 p90 -153.48 153.81 29.66 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.811 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.415 ' C ' ' O ' ' A' ' 37' ' ' TYR . 51.4 Cg_exo -32.08 123.72 0.1 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 123.021 2.48 . . . . 0.0 112.056 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.744 HG22 ' O ' ' A' ' 39' ' ' THR . 23.0 m -123.08 61.12 17.21 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.378 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.531 ' O ' ' N ' ' A' ' 42' ' ' ARG . 61.2 Cg_endo -72.81 -35.65 5.46 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.712 2.274 . . . . 0.0 112.102 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.541 ' O ' ' HB2' ' A' ' 42' ' ' ARG . 4.8 mt 34.13 -89.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.468 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.541 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 1.2 mtp85 71.02 31.6 2.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.753 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.7 p -137.67 -93.26 0.21 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.098 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.405 ' HE3' ' HB2' ' A' ' 44' ' ' LYS . 0.8 OUTLIER -140.21 121.76 15.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.672 -179.805 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 5.9 mmtp -51.38 -177.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.621 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.446 ' O ' ' C ' ' A' ' 47' ' ' MET . 0.9 OUTLIER -123.36 -44.46 2.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.417 -179.645 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.555 ' O ' ' CG ' ' A' ' 47' ' ' MET . 0.0 OUTLIER 34.91 69.61 0.16 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.855 0.359 . . . . 0.0 110.539 -179.407 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.7 -169.47 1.62 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.958 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -85.74 165.06 2.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.874 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 57.38 22.81 8.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.617 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -155.57 76.18 0.94 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.956 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -162.09 25.97 0.11 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.739 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.77 155.63 30.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.27 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.23 -177.97 3.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.891 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.9 m -121.09 87.56 2.78 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.852 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.442 ' O ' ' CB ' ' A' ' 57' ' ' SER . 0.3 OUTLIER -121.58 -177.8 3.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.261 -179.976 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.442 ' CB ' ' O ' ' A' ' 56' ' ' GLU . 0.3 OUTLIER 79.94 -1.14 2.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.542 -179.557 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.495 ' HB ' ' SG ' ' A' ' 84' ' ' CYS . 0.6 OUTLIER -67.2 140.88 57.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.647 179.733 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.555 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 0.7 OUTLIER -145.54 137.1 25.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.172 -179.852 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.704 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -119.82 54.95 0.99 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.391 -179.809 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.561 ' O ' ' C ' ' A' ' 62' ' ' ALA . 6.0 t -56.17 85.01 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.66 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.581 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 7.65 111.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.589 -179.747 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.762 ' N ' ' O ' ' A' ' 81' ' ' ALA . 6.2 tptp -55.2 -39.23 69.39 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.73 0.776 . . . . 0.0 109.377 178.436 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.515 ' HB3' ' OG1' ' A' ' 80' ' ' THR . 0.7 OUTLIER -147.41 133.12 18.89 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.353 179.56 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.669 ' HB2' ' C ' ' A' ' 77' ' ' GLU . 1.6 p90 -115.91 169.54 9.16 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 121.879 0.847 . . . . 0.0 112.527 -178.506 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.772 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -131.45 27.5 4.72 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 113.888 -1.506 . . . . 0.0 107.133 176.104 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.549 ' HA ' ' CA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -4.99 92.6 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.15 -2.296 . . . . 0.0 111.319 -179.736 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.932 HG11 HD11 ' A' ' 25' ' ' ILE . 30.1 t -94.14 71.68 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.401 0 CA-C-N 113.213 -1.812 . . . . 0.0 111.089 -179.27 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.68 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 99.6 m -54.09 117.72 3.46 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.174 0.511 . . . . 0.0 110.441 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.729 HG21 ' CD2' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -128.13 -166.64 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.849 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.683 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 1.5 mmm 35.89 -135.42 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.53 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -82.16 30.33 3.01 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.357 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 106.33 53.9 0.72 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.545 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.683 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 4.0 m-85 -100.42 112.88 25.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.747 0.308 . . . . 0.0 111.047 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.482 ' O ' ' OE2' ' A' ' 77' ' ' GLU . 19.0 mtpt -99.94 108.98 21.35 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.287 0.565 . . . . 0.0 111.433 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.161 HG21 ' CG2' ' A' ' 25' ' ' ILE . 15.8 m -94.76 18.0 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.486 -1.483 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.667 179.163 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.84 ' O ' ' HD2' ' A' ' 79' ' ' HIS . 0.4 OUTLIER 29.77 39.12 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 -176.099 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.924 ' HB2' HG23 ' A' ' 68' ' ' VAL . 38.3 t30 -8.02 70.08 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 113.332 -1.758 . . . . 0.0 108.582 -174.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 1.073 ' N ' HD12 ' A' ' 26' ' ' LEU . 42.5 m170 -40.5 118.04 0.89 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 112.958 -1.928 . . . . 0.0 114.246 -176.154 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.515 ' OG1' ' HB3' ' A' ' 64' ' ' SER . 2.3 p -103.46 -7.78 20.66 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 113.481 -1.69 . . . . 0.0 109.888 178.541 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.762 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -174.38 140.46 0.65 Allowed 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.543 179.177 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.642 ' SG ' HD11 ' A' ' 12' ' ' LEU . 1.3 m -128.54 121.56 29.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.714 0.292 . . . . 0.0 110.268 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.704 ' O ' ' HA ' ' A' ' 60' ' ' CYS . 0.0 OUTLIER -109.85 105.27 14.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.088 0.47 . . . . 0.0 111.677 -179.359 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.555 ' HA ' ' O ' ' A' ' 59' ' ' CYS . 4.6 t -77.16 153.74 33.86 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.729 179.392 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.518 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 0.7 OUTLIER 84.32 40.32 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.931 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.734 HG23 ' O ' ' A' ' 86' ' ' THR . 1.3 t -115.24 38.64 3.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.858 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 57' ' ' SER . 94.5 m -137.93 54.7 1.79 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.057 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 20.2 m-30 51.06 -175.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.194 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 61.56 97.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.245 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -129.87 -15.89 3.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.114 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.5 tttt -95.75 121.37 37.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.769 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.812 179.802 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 1.053 ' H83' ' HB1' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.76 ' O7 ' ' C3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 180' ' ' BMA . . . . . 0.876 ' H62' ' H5 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 181' ' ' MAN . . . . . 0.59 ' C5 ' ' H2 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 182' ' ' MAN . . . . . 0.876 ' H5 ' ' H62' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 183' ' ' NAG . . . . . 0.455 ' H3 ' ' O7 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.564 ' O7 ' ' O2 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 185' ' ' GAL . . . . . 0.41 ' H2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.586 ' HB3' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 120.972 0.415 . . . . 0.0 111.035 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.586 ' HD3' ' HB3' ' A' ' 1' ' ' ALA . 32.3 Cg_exo -57.96 149.7 68.81 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.824 2.35 . . . . 0.0 112.243 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.464 ' O ' ' N ' ' A' ' 5' ' ' GLN . 0.5 OUTLIER -77.33 149.43 35.29 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.901 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.44 HG22 ' O ' ' A' ' 4' ' ' VAL . 8.9 p 37.81 29.0 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.216 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.499 ' HB3' ' HB2' ' A' ' 2' ' ' PRO . 1.7 tp-100 -132.76 78.82 1.81 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.764 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' A' ' 5' ' ' GLN . 2.8 m-20 80.64 -173.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.86 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.42 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -96.12 130.22 31.76 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.991 -179.819 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 7' ' ' CYS . 14.9 Cg_exo -68.22 88.55 0.39 Allowed 'Trans proline' 0 C--O 1.23 0.125 0 C-N-CA 122.843 2.362 . . . . 0.0 112.125 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.521 ' HA ' ' O ' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -45.89 106.03 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.977 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.514 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER 23.15 87.81 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.087 179.921 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.766 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 2.9 t -150.87 -166.77 2.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.263 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.044 HD23 HD13 ' A' ' 26' ' ' LEU . 4.2 mp -100.86 138.87 37.34 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.085 0.469 . . . . 0.0 111.189 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.653 ' CG ' ' HB2' ' A' ' 29' ' ' MET . 2.4 mt-30 -108.92 58.67 0.6 Allowed 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.209 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.641 ' HG3' ' O ' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -4.12 122.28 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 114.03 -1.441 . . . . 0.0 111.469 -179.429 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.761 ' OD1' HG11 ' A' ' 76' ' ' VAL . 0.2 OUTLIER -54.92 117.93 15.66 Favored Pre-proline 0 C--N 1.311 -1.105 0 CA-C-N 114.689 -1.141 . . . . 0.0 111.939 -179.569 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.599 ' HD2' HD21 ' A' ' 15' ' ' ASN . 97.7 Cg_endo -81.16 14.62 2.06 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.682 2.254 . . . . 0.0 111.556 179.009 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.471 ' CD2' ' SD ' ' A' ' 71' ' ' MET . 22.9 t80 -119.46 -55.74 2.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.146 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.841 ' CD2' HG13 ' A' ' 70' ' ' VAL . 0.7 OUTLIER -72.83 -10.67 60.06 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.152 -179.712 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.63 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 11.0 p -58.2 98.31 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.409 -179.55 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.639 ' O ' ' N ' ' A' ' 22' ' ' GLY . 26.2 mt-30 -121.96 152.76 60.14 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.905 178.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -45.28 75.79 0.01 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.178 0 C-N-CA 122.734 2.29 . . . . 0.0 112.638 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.639 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 127.86 2.76 6.09 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.556 -0.831 . . . . 0.0 113.269 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 1.033 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -160.19 98.17 1.46 Allowed Pre-proline 0 CA--C 1.514 -0.432 0 CA-C-O 122.084 0.945 . . . . 0.0 111.769 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.63 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 98.6 Cg_endo -107.73 81.7 0.02 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.575 0 C-N-CA 125.235 3.956 . . . . 0.0 113.5 -178.259 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.295 ' CG2' HG21 ' A' ' 76' ' ' VAL . 23.0 mm -44.75 -177.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.048 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -147.56 -158.79 0.95 Allowed 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 -175.386 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.519 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 6.9 tm0? 161.85 94.85 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 112.431 -2.168 . . . . 0.0 109.601 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.916 ' H ' ' CD2' ' A' ' 79' ' ' HIS . 0.5 OUTLIER -36.01 110.71 0.11 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.9 -178.292 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.658 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.1 tpt -44.27 -78.08 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.938 0.399 . . . . 0.0 110.068 178.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 110.98 55.27 0.51 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.725 -0.75 . . . . 0.0 113.118 179.315 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.521 ' O ' ' HA ' ' A' ' 9' ' ' GLU . 16.7 t -124.96 62.68 1.15 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.944 0.402 . . . . 0.0 110.308 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.47 ' O ' ' O ' ' A' ' 33' ' ' PHE . 0.1 OUTLIER -80.71 23.51 0.53 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.018 -179.19 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.488 ' O ' ' HB3' ' A' ' 34' ' ' SER . 89.3 m-85 55.71 158.34 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.86 0.362 . . . . 0.0 110.771 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.497 ' O ' ' OG ' ' A' ' 34' ' ' SER . 1.0 OUTLIER 173.22 44.96 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.538 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.494 ' CB ' ' O ' ' A' ' 34' ' ' SER . 0.1 OUTLIER 84.97 -167.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.794 -179.844 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -112.92 117.42 32.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.068 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.489 ' C ' ' CD1' ' A' ' 37' ' ' TYR . 0.9 OUTLIER 46.92 87.34 0.12 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.805 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 37' ' ' TYR . 2.2 Cg_endo -41.24 133.98 3.0 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 122.597 2.198 . . . . 0.0 111.546 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.668 ' HB ' ' HD3' ' A' ' 40' ' ' PRO . 1.4 m -148.33 -64.7 0.02 OUTLIER Pre-proline 0 C--N 1.327 -0.408 0 CA-C-O 121.492 0.663 . . . . 0.0 111.339 -179.264 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.668 ' HD3' ' HB ' ' A' ' 39' ' ' THR . 39.2 Cg_endo -68.71 81.63 0.58 Allowed 'Trans proline' 0 C--N 1.325 -0.674 0 C-N-CA 123.693 2.928 . . . . 0.0 112.306 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.56 HD13 ' O ' ' A' ' 39' ' ' THR . 2.6 mp -90.05 -43.01 10.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.006 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.544 ' C ' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -18.35 130.06 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.622 -179.696 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 41' ' ' LEU . 0.1 OUTLIER -178.12 67.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.698 -179.891 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.51 -28.56 56.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.897 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.57 73.35 1.43 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.896 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.475 ' O ' ' C ' ' A' ' 47' ' ' MET . 0.2 OUTLIER -88.76 -23.86 22.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.702 179.966 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.475 ' C ' ' O ' ' A' ' 46' ' ' THR . 0.0 OUTLIER 29.52 90.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.999 179.797 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.569 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 0.9 OUTLIER -88.43 126.31 35.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.304 0.573 . . . . 0.0 111.045 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.709 HG13 ' O ' ' A' ' 49' ' ' VAL . 0.5 OUTLIER 172.75 8.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.92 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.533 ' O ' ' CB ' ' A' ' 51' ' ' LYS . 14.4 mm100 -134.2 156.73 47.85 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.106 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.533 ' CB ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER 84.73 146.79 0.07 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.877 0.37 . . . . 0.0 110.573 -179.721 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.566 ' O ' ' O ' ' A' ' 53' ' ' VAL . 3.4 p30 -72.87 153.66 40.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.427 -179.682 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.566 ' O ' ' O ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER 23.47 106.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.2 179.652 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -92.85 -58.68 2.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.835 179.478 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 25.6 p 45.61 76.43 0.09 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.173 179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -102.85 19.18 19.83 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.957 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.7 t -157.23 76.49 0.84 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.072 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.503 ' O ' ' HB3' ' A' ' 59' ' ' CYS . 7.2 p -71.33 163.03 28.45 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.931 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.52 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 0.8 OUTLIER 176.09 123.65 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.979 0.419 . . . . 0.0 111.927 179.868 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.605 ' O ' ' N ' ' A' ' 62' ' ' ALA . 5.3 p -113.28 43.59 1.71 Allowed 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.628 178.612 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.657 ' O ' HG23 ' A' ' 61' ' ' VAL . 30.9 m -58.15 75.34 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.08 179.366 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.715 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 18.08 103.89 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.656 -178.386 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.973 ' N ' ' O ' ' A' ' 81' ' ' ALA . 6.5 tppt? -52.84 -31.82 41.22 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 121.971 0.891 . . . . 0.0 108.858 178.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.593 ' HB3' ' OG1' ' A' ' 80' ' ' THR . 3.7 t -144.21 152.05 40.33 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 113.806 -1.543 . . . . 0.0 108.535 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.656 ' CG ' ' CG ' ' A' ' 77' ' ' GLU . 1.8 p90 -135.69 164.83 26.98 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.575 0.702 . . . . 0.0 112.093 -179.272 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.674 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 6.6 t-20 -134.66 26.36 3.7 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 122.76 1.267 . . . . 0.0 108.42 177.601 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.696 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -9.95 132.09 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 112.007 -2.36 . . . . 0.0 112.371 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.979 HG21 HG13 ' A' ' 25' ' ' ILE . 2.2 m -140.02 44.19 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.873 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.683 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 45.5 m -10.3 119.1 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.888 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.841 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -116.58 -168.68 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.577 0.704 . . . . 0.0 112.082 179.748 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.66 ' HG3' ' CG ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER 27.96 -139.33 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.581 -1.19 . . . . 0.0 110.954 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -69.5 10.21 2.14 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.614 179.576 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.463 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 129.26 55.58 0.1 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.986 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.683 ' O ' ' HA ' ' A' ' 69' ' ' THR . 2.0 m-85 -95.33 108.57 20.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.988 0.423 . . . . 0.0 111.051 -179.614 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.479 ' HG2' ' OG1' ' A' ' 69' ' ' THR . 5.3 mtpt -96.44 100.26 11.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.369 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.295 HG21 ' CG2' ' A' ' 25' ' ' ILE . 22.6 m -87.38 11.8 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.339 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.307 179.515 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.748 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 30.68 39.11 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 -177.094 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.726 ' HB2' HG13 ' A' ' 68' ' ' VAL . 52.3 t30 -3.68 67.45 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 112.98 -1.918 . . . . 0.0 109.092 -174.943 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 1.048 ' N ' HD12 ' A' ' 26' ' ' LEU . 2.2 m-70 -37.18 119.45 0.68 Allowed 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 112.802 -1.999 . . . . 0.0 114.362 -176.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.593 ' OG1' ' HB3' ' A' ' 64' ' ' SER . 0.7 OUTLIER -108.95 -7.37 15.42 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 113.552 -1.658 . . . . 0.0 109.926 178.136 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.973 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -168.91 122.08 0.81 Allowed 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.98 178.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.488 ' SG ' HD11 ' A' ' 12' ' ' LEU . 1.3 m -119.11 120.09 36.12 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.653 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.786 ' ND1' ' HB2' ' A' ' 63' ' ' LYS . 0.6 OUTLIER -123.69 117.9 26.03 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.1 0.476 . . . . 0.0 112.237 -178.929 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.552 ' O ' ' HB2' ' A' ' 85' ' ' SER . 0.5 OUTLIER -79.54 122.42 26.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.239 179.792 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.552 ' HB2' ' O ' ' A' ' 84' ' ' CYS . 24.0 t 162.48 151.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.629 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.437 ' C ' ' O ' ' A' ' 85' ' ' SER . 3.7 m -36.48 133.57 0.52 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.798 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -124.25 163.83 20.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.628 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.513 ' O ' ' C ' ' A' ' 89' ' ' TYR . 0.1 OUTLIER -179.83 47.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.131 179.933 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.513 ' C ' ' O ' ' A' ' 88' ' ' TYR . 3.2 m-85 24.88 85.95 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.244 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.617 ' O ' ' C ' ' A' ' 91' ' ' LYS . 7.3 p-80 -90.18 -33.48 16.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.906 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.617 ' C ' ' O ' ' A' ' 90' ' ' HIS . 3.3 tttm 6.06 70.25 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.519 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.473 ' N ' ' O ' ' A' ' 90' ' ' HIS . 38.5 t . . . . . 0 C--O 1.247 0.966 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.876 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 1.033 ' H83' ' HB1' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 183' ' ' NAG . . . . . 0.516 ' C6 ' ' O5 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.863 ' H3 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 185' ' ' GAL . . . . . 0.863 ' O2 ' ' H3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 186' ' ' GAL . . . . . 0.516 ' O5 ' ' C6 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.991 0.424 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -84.23 117.55 2.18 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 123.01 2.473 . . . . 0.0 112.725 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -125.07 -85.94 0.63 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.758 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.437 HG22 ' H ' ' A' ' 4' ' ' VAL . 0.8 OUTLIER -59.15 160.87 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.029 179.915 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.535 ' O ' ' CB ' ' A' ' 6' ' ' ASP . 0.2 OUTLIER -91.99 -165.44 1.35 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.93 179.929 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.535 ' CB ' ' O ' ' A' ' 5' ' ' GLN . 5.7 t0 86.74 -147.28 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.605 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 45.9 t -156.12 129.35 4.43 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.808 0.337 . . . . 0.0 111.038 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -51.66 165.54 0.71 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.696 2.264 . . . . 0.0 112.343 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.562 ' CG ' ' CZ ' ' A' ' 33' ' ' PHE . 0.5 OUTLIER -67.08 119.29 11.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.738 179.799 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.699 ' HB2' ' N ' ' A' ' 32' ' ' CYS . 1.8 t -59.21 100.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.168 -179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.489 ' O ' ' N ' ' A' ' 29' ' ' MET . 0.0 OUTLIER -162.76 164.72 26.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.92 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.087 ' CD2' HD13 ' A' ' 26' ' ' LEU . 1.4 mp -60.35 124.25 19.76 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.062 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.654 ' HG3' ' CB ' ' A' ' 29' ' ' MET . 0.7 OUTLIER -116.67 60.52 0.74 Allowed 'General case' 0 CA--C 1.502 -0.867 0 CA-C-O 122.044 0.925 . . . . 0.0 111.723 -179.257 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.684 ' CD ' ' HB2' ' A' ' 24' ' ' PRO . 33.3 tt0 3.92 120.42 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 112.949 -1.932 . . . . 0.0 111.459 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.75 ' ND2' HG11 ' A' ' 76' ' ' VAL . 0.5 OUTLIER -53.89 100.74 0.23 Allowed Pre-proline 0 C--N 1.307 -1.264 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.562 -179.608 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.616 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 56.8 Cg_endo -69.98 5.4 1.8 Allowed 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 121.702 1.602 . . . . 0.0 109.951 178.054 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.597 ' CZ ' ' SD ' ' A' ' 71' ' ' MET . 0.3 OUTLIER -101.47 -60.64 1.49 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 113.992 -1.458 . . . . 0.0 110.847 -179.779 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.914 ' CD2' HG21 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -82.67 -2.17 53.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.651 -179.576 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.629 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -59.27 83.77 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.598 179.647 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.56 ' O ' ' N ' ' A' ' 22' ' ' GLY . 4.2 mt-30 -92.94 164.88 20.09 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.407 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.16 59.22 0.17 Allowed 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 122.527 2.151 . . . . 0.0 111.174 179.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.56 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 154.7 -14.93 0.53 Allowed Glycine 0 N--CA 1.449 -0.461 0 CA-C-N 115.716 -0.674 . . . . 0.0 112.549 -179.379 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.969 ' HB1' ' C8 ' ' A' ' 178' ' ' NAG . . . -142.52 105.16 5.45 Favored Pre-proline 0 CA--C 1.513 -0.448 0 CA-C-O 121.916 0.865 . . . . 0.0 111.374 -179.588 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.72 ' HD2' ' H3 ' ' A' ' 178' ' ' NAG . 71.9 Cg_endo -104.05 75.93 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.391 0 C-N-CA 124.687 3.592 . . . . 0.0 114.358 -177.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.275 ' CG2' HG21 ' A' ' 76' ' ' VAL . 15.2 mm -44.17 -175.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 178.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.087 HD13 ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -148.65 -161.19 1.29 Allowed 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -176.879 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.652 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 20.8 tt0 161.79 82.91 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 112.421 -2.172 . . . . 0.0 110.822 179.545 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 1.3 m -35.06 101.83 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.774 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.654 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -110.33 143.91 39.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.889 0.376 . . . . 0.0 111.225 179.796 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.592 ' HA3' ' HA ' ' A' ' 10' ' ' CYS . . . 131.89 -159.08 23.14 Favored Glycine 0 C--N 1.33 0.23 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.445 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.508 ' O ' ' O ' ' A' ' 32' ' ' CYS . 90.8 m -148.93 91.0 1.81 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.802 0.334 . . . . 0.0 111.039 -179.739 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.699 ' N ' ' HB2' ' A' ' 10' ' ' CYS . 0.1 OUTLIER 31.27 -154.68 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.058 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.562 ' CZ ' ' CG ' ' A' ' 9' ' ' GLU . 2.5 m-85 -131.54 167.78 18.8 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.821 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.542 ' O ' ' N ' ' A' ' 36' ' ' ALA . 1.2 m -108.1 -139.07 0.37 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.978 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 35' ' ' ARG . 0.7 OUTLIER -62.05 66.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.209 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.542 ' N ' ' O ' ' A' ' 34' ' ' SER . . . -65.74 123.98 21.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.153 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.531 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.5 OUTLIER 86.41 90.73 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.058 179.887 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.503 ' O ' HG22 ' A' ' 39' ' ' THR . 10.6 Cg_exo -70.57 -149.85 0.03 OUTLIER 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.916 2.41 . . . . 0.0 112.269 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.556 ' CG2' ' O ' ' A' ' 39' ' ' THR . 0.4 OUTLIER 80.12 111.26 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.757 -179.941 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -65.04 163.85 27.17 Favored 'Trans proline' 0 N--CA 1.465 -0.184 0 C-N-CA 122.791 2.327 . . . . 0.0 112.086 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -137.33 -173.09 3.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.89 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.56 ' CZ ' ' HB2' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -163.66 137.51 5.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.618 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.469 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 11.0 t 65.98 90.71 0.09 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.832 0.349 . . . . 0.0 110.59 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.74 24.43 4.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 -179.643 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.412 ' C ' ' OG1' ' A' ' 46' ' ' THR . 0.0 OUTLIER -56.92 -21.08 27.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.006 -179.924 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.701 ' O ' ' CB ' ' A' ' 47' ' ' MET . 0.0 OUTLIER 176.48 108.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.708 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.701 ' CB ' ' O ' ' A' ' 46' ' ' THR . 2.2 tmm? 126.68 89.08 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.429 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.52 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 1.1 pt? -151.64 30.29 0.59 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.559 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 0.1 OUTLIER -31.6 112.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.089 179.938 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.582 ' O ' ' CB ' ' A' ' 51' ' ' LYS . 0.4 OUTLIER 82.6 179.75 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.919 -179.88 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.582 ' CB ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER 95.49 176.69 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.006 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.469 ' HB2' ' O ' ' A' ' 51' ' ' LYS . 0.8 OUTLIER 79.3 51.12 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.641 -179.812 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.634 ' O ' ' CB ' ' A' ' 54' ' ' THR . 0.1 OUTLIER -150.6 167.48 2.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.278 -179.652 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.634 ' CB ' ' O ' ' A' ' 53' ' ' VAL . 1.7 m 143.16 153.33 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.608 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.466 ' HB2' ' O ' ' A' ' 54' ' ' THR . 9.8 m 77.49 151.89 0.13 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.958 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 25.8 pt-20 -43.56 145.4 0.63 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.997 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 169.66 -94.78 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.552 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.429 ' HA ' ' O ' ' A' ' 85' ' ' SER . 0.0 OUTLIER -49.1 166.79 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.457 -179.482 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.555 ' N ' ' O ' ' A' ' 85' ' ' SER . 35.1 m -151.0 132.92 15.1 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.01 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.7 m -82.06 101.14 10.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.209 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.598 HG13 ' O ' ' A' ' 61' ' ' VAL . 7.1 p -111.65 70.92 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.739 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.587 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 9.11 107.31 0.0 OUTLIER 'General case' 0 C--O 1.231 0.103 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.164 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.882 ' N ' ' O ' ' A' ' 81' ' ' ALA . 2.4 ttmm -55.35 -39.3 69.89 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.652 0.739 . . . . 0.0 109.372 178.625 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.513 ' N ' ' HB3' ' A' ' 81' ' ' ALA . 2.4 m -144.13 135.03 25.23 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.108 179.362 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.868 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.2 OUTLIER -119.45 160.59 22.06 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.128 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.936 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -123.6 27.65 7.29 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-O 122.5 1.143 . . . . 0.0 107.938 177.423 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.539 ' O ' ' O ' ' A' ' 66' ' ' ASN . 1.9 ttm180 -6.33 128.67 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 112.311 -2.222 . . . . 0.0 112.237 -179.647 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.979 HG21 ' CD1' ' A' ' 25' ' ' ILE . 1.5 m -134.64 36.04 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.954 179.667 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.594 ' C ' ' O ' ' A' ' 68' ' ' VAL . 23.4 m -17.34 120.55 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.471 -179.688 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.914 HG21 ' CD2' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -125.92 -168.01 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-O 121.718 0.771 . . . . 0.0 112.447 -178.457 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.601 ' H ' HG12 ' A' ' 70' ' ' VAL . 0.5 OUTLIER 43.86 -134.49 0.57 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.411 -1.268 . . . . 0.0 111.062 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.439 ' H ' ' HB3' ' A' ' 71' ' ' MET . . . -84.94 23.02 8.25 Favored Glycine 0 N--CA 1.434 -1.45 0 C-N-CA 120.71 -0.757 . . . . 0.0 111.694 179.473 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 118.03 37.09 0.9 Allowed Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.183 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.586 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 3.3 m-85 -68.64 -177.66 1.0 Allowed 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 1.5 mtmp? -159.53 134.37 7.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.273 0.559 . . . . 0.0 111.972 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.275 HG21 ' CG2' ' A' ' 25' ' ' ILE . 18.8 m -140.07 15.22 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.492 -1.255 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.476 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.868 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 20.42 46.58 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -178.069 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.989 ' OD1' HD11 ' A' ' 26' ' ' LEU . 27.4 t-20 1.18 70.78 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 114.262 -1.335 . . . . 0.0 108.215 -174.73 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 1.02 ' O ' HD21 ' A' ' 12' ' ' LEU . 33.6 m170 -39.36 111.42 0.18 Allowed 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 122.582 1.182 . . . . 0.0 111.957 -176.502 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.664 HG23 ' O ' ' A' ' 78' ' ' ASN . 8.9 p -108.16 -9.33 15.58 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.601 -1.636 . . . . 0.0 110.101 -179.375 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.882 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -165.42 128.55 2.19 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 178.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.1 OUTLIER -117.67 143.39 46.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.668 0.271 . . . . 0.0 110.753 -178.935 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.448 ' NE2' ' HA ' ' A' ' 63' ' ' LYS . 0.3 OUTLIER -152.97 116.12 4.62 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.867 0.365 . . . . 0.0 111.516 -179.473 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.07 127.38 31.26 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.512 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.555 ' O ' ' N ' ' A' ' 59' ' ' CYS . 0.4 OUTLIER -149.46 -153.29 0.48 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.764 -179.957 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.5 34.17 0.82 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.947 0.403 . . . . 0.0 110.587 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.479 ' O ' ' O ' ' A' ' 88' ' ' TYR . 0.0 OUTLIER 45.78 -169.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.809 -179.87 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.479 ' O ' ' O ' ' A' ' 87' ' ' CYS . 2.6 p90 -38.27 163.8 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.928 0.394 . . . . 0.0 111.284 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.443 ' HB3' ' CE1' ' A' ' 90' ' ' HIS . 14.1 m-85 -130.72 -92.62 0.42 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.537 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.443 ' CE1' ' HB3' ' A' ' 89' ' ' TYR . 0.0 OUTLIER -131.55 86.74 2.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.548 179.535 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 90' ' ' HIS . 3.2 ttmt 65.41 118.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.778 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.183 -0.913 . . . . 0.0 110.906 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 1.021 ' H82' HD11 ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.576 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 180' ' ' BMA . . . . . 0.455 ' H61' ' H2 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 182' ' ' MAN . . . . . 0.455 ' H2 ' ' H61' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 183' ' ' NAG . . . . . 0.753 ' H3 ' ' O2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 186' ' ' GAL . . . . . 0.753 ' O2 ' ' H3 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.262 0 CA-C-O 120.838 0.351 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.486 ' O ' ' O ' ' A' ' 3' ' ' ASP . 94.0 Cg_exo -38.11 -39.18 0.9 Allowed 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.912 2.408 . . . . 0.0 112.481 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.486 ' O ' ' O ' ' A' ' 2' ' ' PRO . 0.2 OUTLIER 35.65 -158.88 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.983 179.912 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 47.2 t -110.59 146.66 15.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.114 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.515 ' O ' ' CB ' ' A' ' 6' ' ' ASP . 23.9 mt-30 -106.92 81.73 1.6 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.83 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.515 ' CB ' ' O ' ' A' ' 5' ' ' GLN . 0.0 OUTLIER 162.21 159.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.849 0.357 . . . . 0.0 111.202 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 6' ' ' ASP . 0.5 OUTLIER 174.27 151.07 0.25 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.986 179.608 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.613 ' O ' ' HB2' ' A' ' 31' ' ' CYS . 65.9 Cg_endo -81.38 -123.45 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.888 2.392 . . . . 0.0 110.36 178.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.574 ' O ' ' N ' ' A' ' 11' ' ' THR . 2.1 mp0 -149.22 -175.76 5.1 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.052 0.453 . . . . 0.0 110.704 178.701 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.655 ' N ' ' O ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -47.29 86.52 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.829 179.867 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.593 ' O ' ' N ' ' A' ' 29' ' ' MET . 0.0 OUTLIER -115.19 156.04 26.06 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.388 -178.944 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.102 HD21 ' O ' ' A' ' 79' ' ' HIS . 3.5 mp -51.2 123.07 8.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.243 179.509 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.704 ' O ' ' O ' ' A' ' 14' ' ' GLU . 2.0 mm-40 -123.34 61.45 1.05 Allowed 'General case' 0 CA--C 1.502 -0.895 0 CA-C-O 122.251 1.024 . . . . 0.0 110.933 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.704 ' O ' ' O ' ' A' ' 13' ' ' GLN . 16.6 tt0 8.29 126.92 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 112.484 -2.144 . . . . 0.0 112.313 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.732 ' OD1' HG11 ' A' ' 76' ' ' VAL . 0.1 OUTLIER -49.86 128.96 21.11 Favored Pre-proline 0 C--N 1.311 -1.096 0 CA-C-N 114.232 -1.349 . . . . 0.0 111.253 179.694 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.441 ' HD2' HD21 ' A' ' 15' ' ' ASN . 93.8 Cg_endo -86.06 27.87 0.57 Allowed 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.598 2.198 . . . . 0.0 111.517 179.239 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.565 ' HB2' ' HE1' ' A' ' 71' ' ' MET . 54.2 t80 -143.29 -52.65 0.36 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.924 -179.553 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.966 ' CE2' HG23 ' A' ' 68' ' ' VAL . 0.2 OUTLIER -74.86 -15.43 60.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.28 -179.163 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.92 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -55.5 92.54 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.315 -179.547 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.541 ' O ' ' N ' ' A' ' 22' ' ' GLY . 7.3 mm-40 -121.07 166.51 15.66 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-O 120.916 0.388 . . . . 0.0 111.147 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.5 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 31.2 Cg_exo -59.28 64.46 0.06 OUTLIER 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.992 2.461 . . . . 0.0 112.194 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.541 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 144.94 -9.89 1.81 Allowed Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.35 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.999 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -153.19 99.13 2.71 Favored Pre-proline 0 CA--C 1.51 -0.583 0 CA-C-O 122.02 0.914 . . . . 0.0 111.798 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.92 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 71.7 Cg_endo -107.64 72.71 0.02 OUTLIER 'Trans proline' 0 N--CA 1.436 -1.878 0 C-N-CA 124.965 3.777 . . . . 0.0 113.251 -178.431 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.237 ' CG2' HG21 ' A' ' 76' ' ' VAL . 22.7 mm -40.09 -176.89 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.043 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.158 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.018 HD11 ' OD1' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -148.58 -159.58 1.05 Allowed 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 122.484 1.135 . . . . 0.0 113.826 -176.356 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.539 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 1.2 tp-100 160.01 75.29 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 112.921 -1.945 . . . . 0.0 110.802 179.646 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 2.3 m -22.74 111.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.618 -179.553 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.593 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.8 OUTLIER -144.69 130.5 19.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.638 179.64 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 173.13 -115.49 0.56 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.164 -1.017 . . . . 0.0 113.54 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.655 ' O ' ' N ' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -115.35 -164.36 0.94 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.276 0.56 . . . . 0.0 111.706 -179.263 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.645 ' CB ' ' O ' ' A' ' 31' ' ' CYS . 4.1 t 106.34 -139.31 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.98 -1.009 . . . . 0.0 109.811 -179.205 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.91 ' H ' HG23 ' A' ' 58' ' ' THR . 0.0 OUTLIER 56.07 -166.48 0.12 Allowed 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.585 179.025 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -147.22 -168.37 3.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.961 0.41 . . . . 0.0 111.364 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -77.18 144.55 38.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.133 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -110.23 20.01 18.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.912 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.424 ' O ' ' O ' ' A' ' 38' ' ' PRO . 0.9 OUTLIER -118.65 120.5 31.66 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.915 -179.968 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.48 ' O ' ' HB ' ' A' ' 39' ' ' THR . 96.3 Cg_exo -46.25 179.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.219 0 C-N-CA 122.683 2.256 . . . . 0.0 112.372 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.55 ' OG1' ' HD2' ' A' ' 40' ' ' PRO . 1.3 t 169.57 155.05 0.18 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.784 -179.475 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.55 ' HD2' ' OG1' ' A' ' 39' ' ' THR . 90.4 Cg_exo -30.68 -38.08 0.05 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 122.814 2.343 . . . . 0.0 112.022 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.493 ' O ' ' O ' ' A' ' 39' ' ' THR . 0.1 OUTLIER -73.16 -173.53 1.33 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.639 179.688 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.454 ' O ' ' HD3' ' A' ' 44' ' ' LYS . 5.1 mtp-105 -158.86 -37.43 0.06 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.52 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.511 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 1.1 m 41.63 -149.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.893 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.511 ' HB2' ' O ' ' A' ' 43' ' ' SER . 0.1 OUTLIER 68.76 33.16 3.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.184 179.893 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.45 ' O ' ' O ' ' A' ' 46' ' ' THR . 9.0 ttpp -115.2 -37.85 3.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.63 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.45 ' O ' ' O ' ' A' ' 45' ' ' LYS . 24.1 p 44.48 -173.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.934 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.2 -74.28 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.122 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.657 ' C ' HG23 ' A' ' 49' ' ' VAL . 0.9 OUTLIER -145.0 71.91 1.31 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.94 -179.747 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.657 HG23 ' C ' ' A' ' 48' ' ' LEU . 1.2 t 69.87 -144.82 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.142 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.533 ' O ' ' N ' ' A' ' 52' ' ' ASN . 0.1 OUTLIER -174.63 105.42 0.1 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.561 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.53 ' O ' ' HB2' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -56.47 77.75 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.153 -179.546 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.533 ' N ' ' O ' ' A' ' 50' ' ' GLN . 10.9 t-20 174.64 104.26 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.907 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.2 m -53.31 175.14 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.827 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 60.9 p 51.01 93.57 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.933 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -161.89 125.31 3.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.918 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -145.27 -35.55 0.31 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.096 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 38.3 m -133.58 -95.36 0.3 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.781 0.324 . . . . 0.0 111.096 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.91 HG23 ' H ' ' A' ' 33' ' ' PHE . 0.2 OUTLIER -59.97 -165.71 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.969 0.414 . . . . 0.0 111.059 -179.892 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.655 ' H ' HG22 ' A' ' 58' ' ' THR . 1.8 t -162.23 28.04 0.11 Allowed 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.788 0.804 . . . . 0.0 110.66 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.649 ' O ' HG12 ' A' ' 61' ' ' VAL . 0.1 OUTLIER -74.57 -162.38 0.16 Allowed 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.538 179.333 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.745 HG13 ' O ' ' A' ' 61' ' ' VAL . 4.3 p 116.08 42.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 114.291 -1.322 . . . . 0.0 109.317 -179.691 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.763 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 37.29 113.78 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.527 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.74 ' N ' ' O ' ' A' ' 81' ' ' ALA . 4.3 ttmm -52.33 -39.66 60.93 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.674 0.75 . . . . 0.0 109.014 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.529 ' HB3' ' OG1' ' A' ' 80' ' ' THR . 4.4 m -141.13 139.78 34.01 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.971 178.825 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.684 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 7.2 p90 -123.51 159.38 29.24 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.181 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.928 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -126.71 26.07 6.3 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 122.825 1.298 . . . . 0.0 107.826 176.87 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.522 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -3.0 129.75 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 111.912 -2.404 . . . . 0.0 113.766 -179.273 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.966 HG23 ' CE2' ' A' ' 18' ' ' PHE . 1.9 m -149.26 87.7 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.962 178.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.663 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 98.7 m -57.5 127.0 29.82 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.6 0.714 . . . . 0.0 111.955 -178.04 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.831 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -126.27 -170.23 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 114.684 -1.144 . . . . 0.0 111.124 179.383 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.565 ' HE1' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER 30.55 -136.55 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.058 179.592 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -73.23 21.57 1.06 Allowed Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.695 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.642 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 115.54 33.75 1.54 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.555 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.663 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.2 m-85 -69.0 110.46 4.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.106 0.479 . . . . 0.0 111.233 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.81 89.63 5.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.807 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.237 HG21 ' CG2' ' A' ' 25' ' ' ILE . 25.5 m -78.76 13.89 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.495 -1.155 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.904 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.7 ' O ' ' C ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER 23.76 44.74 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 105.685 -1.969 . . . . 0.0 105.685 -177.698 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 1.018 ' OD1' HD11 ' A' ' 26' ' ' LEU . 26.6 t-20 1.48 71.96 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.096 0 CA-C-N 114.196 -1.365 . . . . 0.0 108.371 -174.22 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 1.102 ' O ' HD21 ' A' ' 12' ' ' LEU . 36.4 m170 -41.85 111.6 0.25 Allowed 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 122.644 1.211 . . . . 0.0 111.93 -176.73 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.582 HG23 ' O ' ' A' ' 78' ' ' ASN . 7.6 p -104.53 -3.32 24.05 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 113.6 -1.637 . . . . 0.0 109.628 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.74 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -171.96 138.6 1.05 Allowed 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.2 OUTLIER -120.86 157.24 30.23 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.729 -0.389 . . . . 0.0 111.325 -179.031 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.574 ' O ' ' O ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER -165.75 106.22 0.73 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.343 179.553 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.672 ' HB2' HG22 ' A' ' 58' ' ' THR . 3.9 p -118.38 160.2 22.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.441 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.491 ' C ' ' O ' ' A' ' 84' ' ' CYS . 3.7 p 28.68 37.17 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.923 0.392 . . . . 0.0 110.959 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.569 ' N ' ' O ' ' A' ' 84' ' ' CYS . 0.2 OUTLIER -170.39 50.54 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.604 -179.743 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 86.2 m -80.56 51.37 1.46 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.918 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.567 ' O ' ' CB ' ' A' ' 89' ' ' TYR . 0.4 OUTLIER -152.61 -160.19 1.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.79 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.567 ' CB ' ' O ' ' A' ' 88' ' ' TYR . 0.2 OUTLIER 90.69 -72.66 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.909 -179.898 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.465 ' O ' ' O ' ' A' ' 91' ' ' LYS . 1.6 t60 -104.79 137.87 41.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.87 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.465 ' O ' ' O ' ' A' ' 90' ' ' HIS . 0.0 OUTLIER 39.19 97.6 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.991 179.901 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.8 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.891 -179.942 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 0.999 ' H83' ' HB1' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.563 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 180' ' ' BMA . . . . . 0.417 ' O4 ' ' H3 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 181' ' ' MAN . . . . . 0.417 ' H3 ' ' O4 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.591 ' H3 ' ' O5 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 185' ' ' GAL . . . . . 0.591 ' O5 ' ' H3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.755 ' HB3' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.284 0 CA-C-O 120.872 0.368 . . . . 0.0 111.102 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.755 ' HD3' ' HB3' ' A' ' 1' ' ' ALA . 58.6 Cg_endo -72.09 -91.59 0.01 OUTLIER 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.912 2.408 . . . . 0.0 112.486 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.404 ' O ' ' HB ' ' A' ' 4' ' ' VAL . 0.2 OUTLIER 50.14 50.46 18.55 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.757 -179.933 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.404 ' HB ' ' O ' ' A' ' 3' ' ' ASP . 11.5 t 74.99 83.52 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.007 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -142.07 96.83 3.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.673 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.406 ' OD1' ' C ' ' A' ' 6' ' ' ASP . 1.8 p30 -141.35 176.07 9.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.977 -179.698 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.549 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -68.54 -60.49 4.68 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.14 179.944 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.571 ' O ' ' HB3' ' A' ' 9' ' ' GLU . 14.8 Cg_exo -32.87 104.94 0.03 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 123.18 2.587 . . . . 0.0 112.388 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.571 ' HB3' ' O ' ' A' ' 8' ' ' PRO . 32.5 tt0 83.09 116.96 0.05 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.329 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.587 ' C ' HG22 ' A' ' 11' ' ' THR . 0.1 OUTLIER -82.98 151.72 25.74 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.215 179.419 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.903 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.2 OUTLIER -168.99 -135.14 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.326 179.917 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.119 HD21 ' O ' ' A' ' 79' ' ' HIS . 0.5 OUTLIER -114.38 129.71 56.66 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.668 179.83 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.668 ' HG3' ' CB ' ' A' ' 29' ' ' MET . 1.8 mm-40 -97.84 44.83 1.03 Allowed 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 121.7 0.762 . . . . 0.0 110.81 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.797 ' HG3' HD23 ' A' ' 26' ' ' LEU . 5.9 tt0 -5.22 122.8 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 113.617 -1.629 . . . . 0.0 110.945 -179.377 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.852 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.6 OUTLIER -69.38 105.07 0.91 Allowed Pre-proline 0 C--N 1.309 -1.156 0 CA-C-N 114.691 -1.14 . . . . 0.0 113.095 -178.343 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.516 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 3.7 Cg_exo -78.33 3.81 6.82 Favored 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 122.819 2.346 . . . . 0.0 109.472 177.328 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.507 ' HB3' ' OD1' ' A' ' 15' ' ' ASN . 1.3 t80 -94.61 -63.35 1.19 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 113.874 -1.512 . . . . 0.0 110.08 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 1.059 ' CG ' HG21 ' A' ' 70' ' ' VAL . 8.4 m-85 -79.7 -0.39 33.89 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.362 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.769 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -53.94 104.18 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.942 -179.793 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.712 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 0.3 OUTLIER -106.43 177.17 1.41 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.833 179.85 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.525 ' HD2' ' HB2' ' A' ' 20' ' ' GLN . 35.1 Cg_exo -59.55 68.23 0.06 OUTLIER 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.676 2.251 . . . . 0.0 112.018 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.528 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 124.65 19.51 2.51 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.395 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 1.218 ' CB ' ' H83' ' A' ' 178' ' ' NAG . . . -167.0 100.77 0.64 Allowed Pre-proline 0 CA--C 1.509 -0.61 0 CA-C-O 121.952 0.882 . . . . 0.0 110.971 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.793 ' O ' ' O ' ' A' ' 25' ' ' ILE . 28.1 Cg_endo -94.35 23.85 0.42 Allowed 'Trans proline' 0 N--CA 1.452 -0.968 0 C-N-CA 124.525 3.484 . . . . 0.0 113.049 -178.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.143 ' CG2' HG21 ' A' ' 76' ' ' VAL . 9.8 mm 25.38 -174.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 114.684 -1.144 . . . . 0.0 113.046 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.091 HD13 ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -159.75 -160.61 0.83 Allowed 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -174.723 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.595 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 2.6 tp60 161.27 59.5 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 112.176 -2.284 . . . . 0.0 110.477 179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.687 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 73.6 m -15.87 121.29 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.266 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.668 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -156.68 127.96 6.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.757 179.063 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 170.9 -130.81 2.06 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.324 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 70.7 m -144.24 118.98 9.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.77 0.319 . . . . 0.0 110.824 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.607 ' O ' ' CD1' ' A' ' 33' ' ' PHE . 33.8 t -57.11 -66.75 0.4 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.92 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.607 ' CD1' ' O ' ' A' ' 32' ' ' CYS . 0.7 OUTLIER 162.03 -79.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.827 -179.86 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.501 ' C ' ' O ' ' A' ' 33' ' ' PHE . 1.4 t 27.42 90.19 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.071 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.499 ' C ' ' O ' ' A' ' 34' ' ' SER . 7.9 ttm180 -25.76 139.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.481 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.429 ' N ' ' HG2' ' A' ' 35' ' ' ARG . . . -133.36 -139.98 0.19 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.743 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.573 ' N ' ' HD3' ' A' ' 38' ' ' PRO . 1.0 OUTLIER -139.67 49.22 1.87 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 120.828 0.347 . . . . 0.0 111.024 179.907 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.573 ' HD3' ' N ' ' A' ' 37' ' ' TYR . 95.8 Cg_endo -84.0 122.49 2.97 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.849 2.366 . . . . 0.0 112.24 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.788 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 88.5 m -72.84 -34.12 2.36 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.409 0.623 . . . . 0.0 111.378 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.788 ' CD ' ' N ' ' A' ' 39' ' ' THR . 93.5 Cg_endo -88.62 104.18 0.44 Allowed 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 123.92 3.08 . . . . 0.0 112.837 -179.653 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.493 HD21 ' HG2' ' A' ' 38' ' ' PRO . 81.7 mt -132.98 -51.16 0.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.19 0.519 . . . . 0.0 109.93 179.378 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -128.56 11.11 6.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.001 179.175 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -168.69 135.4 1.88 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.345 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -83.21 52.35 2.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.209 -179.731 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.39 148.91 30.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.52 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.76 107.51 7.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.712 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.474 ' O ' ' O ' ' A' ' 48' ' ' LEU . 0.8 OUTLIER -162.5 62.52 0.21 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.218 -179.746 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.474 ' O ' ' O ' ' A' ' 47' ' ' MET . 0.1 OUTLIER 35.6 96.54 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.015 179.887 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.532 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -146.96 94.13 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.898 179.885 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.532 ' CB ' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER 156.62 92.5 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.196 -179.603 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.608 ' O ' ' CB ' ' A' ' 52' ' ' ASN . 7.5 ttpp -131.8 10.87 4.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.583 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.608 ' CB ' ' O ' ' A' ' 51' ' ' LYS . 2.9 m-20 150.15 147.47 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.459 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.54 ' CG1' ' O ' ' A' ' 52' ' ' ASN . 22.0 m -163.64 -164.25 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.664 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.615 ' O ' ' CB ' ' A' ' 55' ' ' SER . 0.0 OUTLIER -43.44 -86.55 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.651 179.686 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.615 ' CB ' ' O ' ' A' ' 54' ' ' THR . 2.1 m 146.66 54.51 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.797 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.497 ' CB ' ' O ' ' A' ' 55' ' ' SER . 2.0 tm-20 83.15 97.19 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.83 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.75 -170.77 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.893 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 16.9 p -73.44 168.35 19.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.073 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.519 ' C ' ' HA ' ' A' ' 84' ' ' CYS . 30.0 p -145.04 129.34 17.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.014 0.435 . . . . 0.0 110.944 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.673 ' HB2' ' HB3' ' A' ' 82' ' ' CYS . 22.2 p -51.94 130.84 30.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.8 -179.48 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.849 ' O ' HG12 ' A' ' 61' ' ' VAL . 25.3 t -128.06 64.01 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.354 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.819 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 26.18 92.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.431 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.86 ' N ' ' O ' ' A' ' 81' ' ' ALA . 8.6 tptp -47.04 -33.84 5.19 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 177.496 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.746 ' O ' ' HB1' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -139.34 -175.61 4.24 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 113.833 -1.531 . . . . 0.0 108.646 178.982 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.907 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -158.88 162.98 37.0 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.554 0.692 . . . . 0.0 112.246 -179.466 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.789 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.2 OUTLIER -133.84 27.53 3.94 Favored 'General case' 0 CA--C 1.504 -0.817 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 176.777 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.631 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -8.66 129.9 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 112.205 -2.27 . . . . 0.0 111.935 -179.607 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 1.029 HG21 ' CD1' ' A' ' 25' ' ' ILE . 4.3 m -134.04 46.85 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.759 179.589 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.565 ' C ' ' O ' ' A' ' 68' ' ' VAL . 41.1 m -20.09 118.56 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.993 -178.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 1.059 HG21 ' CG ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -123.41 -170.0 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.109 -179.048 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.639 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 80.7 mtp 38.99 -134.23 0.14 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.635 179.57 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -75.87 12.33 8.99 Favored Glycine 0 N--CA 1.441 -0.992 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.976 -179.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 122.1 37.67 0.64 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.236 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.639 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 7.1 m-85 -67.14 -176.27 0.53 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.94 92.85 0.87 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.722 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.143 HG21 ' CG2' ' A' ' 25' ' ' ILE . 29.8 m -86.24 10.6 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.342 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.619 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.907 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.5 OUTLIER 30.53 39.38 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 -176.986 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.974 ' HB2' HG13 ' A' ' 68' ' ' VAL . 48.7 t30 1.75 64.69 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 113.081 -1.872 . . . . 0.0 108.26 -174.391 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 1.119 ' O ' HD21 ' A' ' 12' ' ' LEU . 32.8 m170 -31.73 121.49 0.27 Allowed 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 112.764 -2.017 . . . . 0.0 113.28 -176.909 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.565 ' OG1' ' HB2' ' A' ' 64' ' ' SER . 6.9 p -111.08 -13.64 14.02 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 113.999 -1.455 . . . . 0.0 110.568 -179.812 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.86 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -164.18 135.26 4.42 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.458 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.944 ' SG ' HD12 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -114.03 127.1 55.79 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.474 -0.49 . . . . 0.0 112.23 -178.765 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.494 ' O ' ' CG ' ' A' ' 83' ' ' HIS . 8.4 p-80 -122.49 116.56 24.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.934 178.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.554 ' HA ' ' HA ' ' A' ' 60' ' ' CYS . 31.6 p -69.62 146.73 51.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.082 0.468 . . . . 0.0 111.478 -179.131 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.444 ' OG ' ' N ' ' A' ' 86' ' ' THR . 0.1 OUTLIER -179.78 177.04 0.72 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.853 -179.866 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.444 ' N ' ' OG ' ' A' ' 85' ' ' SER . 4.2 t -34.63 135.66 0.17 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.141 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 3.9 m -115.11 -170.69 1.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.602 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.489 ' O ' ' O ' ' A' ' 89' ' ' TYR . 0.1 OUTLIER 40.4 48.22 2.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.595 179.892 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.543 ' N ' ' CD1' ' A' ' 89' ' ' TYR . 0.0 OUTLIER -36.91 163.28 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.118 -179.71 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -129.99 64.97 1.51 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.888 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 71.08 -71.12 0.14 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.981 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.843 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 1.218 ' H83' ' CB ' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.602 ' O7 ' ' H3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 180' ' ' BMA . . . . . 0.485 ' H61' ' H2 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 182' ' ' MAN . . . . . 0.485 ' H2 ' ' H61' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 183' ' ' NAG . . . . . 0.622 ' H4 ' ' O2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 186' ' ' GAL . . . . . 0.622 ' O2 ' ' H4 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.854 0.359 . . . . 0.0 111.077 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.538 ' O ' ' CB ' ' A' ' 3' ' ' ASP . 19.0 Cg_endo -57.91 -168.43 0.03 OUTLIER 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.703 2.268 . . . . 0.0 111.851 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.538 ' CB ' ' O ' ' A' ' 2' ' ' PRO . 0.3 OUTLIER 85.47 -17.44 0.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.179 179.931 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.434 ' H ' HG23 ' A' ' 4' ' ' VAL . 1.4 t -70.81 -138.79 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.945 179.687 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -139.41 23.28 2.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.839 0.352 . . . . 0.0 111.228 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.7 t70 179.99 155.02 0.58 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.677 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -179.57 83.18 0.2 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.822 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -85.11 59.34 5.34 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 123.116 2.544 . . . . 0.0 113.046 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.481 ' HA ' ' O ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER 72.75 172.62 0.3 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.963 0.411 . . . . 0.0 111.424 179.386 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.71 ' O ' HG23 ' A' ' 11' ' ' THR . 0.1 OUTLIER -95.46 145.64 25.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.843 179.849 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.71 HG23 ' O ' ' A' ' 10' ' ' CYS . 0.3 OUTLIER 157.66 164.92 0.01 OUTLIER 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.339 0.59 . . . . 0.0 111.973 178.946 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.242 HD21 ' O ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER -67.59 113.33 5.32 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.997 -1.002 . . . . 0.0 109.602 178.205 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.605 ' HG3' ' HB2' ' A' ' 29' ' ' MET . 1.3 mm-40 -101.77 52.75 0.82 Allowed 'General case' 0 CA--C 1.499 -0.997 0 CA-C-O 122.119 0.962 . . . . 0.0 110.527 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.595 ' C ' ' O ' ' A' ' 13' ' ' GLN . 4.7 tt0 -4.47 118.0 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 112.761 -2.018 . . . . 0.0 110.845 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.697 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.4 OUTLIER -54.63 102.54 0.31 Allowed Pre-proline 0 C--N 1.302 -1.489 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.382 -178.787 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.454 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 1.4 Cg_endo -76.65 1.33 8.62 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.223 1.949 . . . . 0.0 109.046 177.349 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.736 ' CE1' ' HE1' ' A' ' 71' ' ' MET . 1.1 t80 -93.51 -53.64 3.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 113.518 -1.674 . . . . 0.0 110.08 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.88 ' CE2' HG21 ' A' ' 70' ' ' VAL . 4.0 m-85 -87.5 -4.98 58.99 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.63 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.646 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.7 OUTLIER -48.46 97.36 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.346 179.402 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.62 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -101.23 158.28 32.09 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.667 -179.511 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.438 ' CD ' ' HG3' ' A' ' 20' ' ' GLN . 32.5 Cg_exo -57.98 65.76 0.05 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.582 2.188 . . . . 0.0 111.044 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.62 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 134.66 1.06 3.49 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.168 -179.134 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 1.069 ' CB ' ' H83' ' A' ' 178' ' ' NAG . . . -150.82 99.99 3.1 Favored Pre-proline 0 CA--C 1.512 -0.519 0 CA-C-O 122.022 0.915 . . . . 0.0 111.424 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.646 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 93.2 Cg_endo -103.23 78.87 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.414 0 C-N-CA 124.809 3.673 . . . . 0.0 113.318 -178.492 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.182 ' CG2' HG21 ' A' ' 76' ' ' VAL . 15.3 mm -40.45 -177.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.014 HD13 HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -150.75 -162.76 1.62 Allowed 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 122.413 1.102 . . . . 0.0 113.662 -175.856 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.546 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 7.5 tp-100 166.92 59.76 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 112.918 -1.947 . . . . 0.0 111.104 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.644 ' HA ' ' O ' ' A' ' 11' ' ' THR . 7.4 t -28.2 99.71 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.975 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.605 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 8.2 tpt -61.44 164.11 6.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.206 178.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.685 ' HA2' ' HB2' ' A' ' 10' ' ' CYS . . . -132.81 101.36 0.44 Allowed Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.184 -1.008 . . . . 0.0 113.131 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.481 ' O ' ' HA ' ' A' ' 9' ' ' GLU . 1.8 m -158.53 52.59 0.42 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.847 0.356 . . . . 0.0 110.73 179.666 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.662 ' O ' ' CB ' ' A' ' 33' ' ' PHE . 0.7 OUTLIER -41.66 -74.9 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.714 -179.967 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.662 ' CB ' ' O ' ' A' ' 32' ' ' CYS . 16.5 m-85 114.33 5.63 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.043 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.481 ' O ' ' O ' ' A' ' 33' ' ' PHE . 0.3 OUTLIER 57.32 127.4 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.804 179.864 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.417 ' O ' ' HG3' ' A' ' 35' ' ' ARG . 11.8 ptt-85 -128.67 16.58 6.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.824 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -145.48 138.46 26.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.453 -179.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.533 ' CB ' ' HD3' ' A' ' 38' ' ' PRO . 0.2 OUTLIER 179.92 -54.34 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.263 179.679 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.533 ' HD3' ' CB ' ' A' ' 37' ' ' TYR . 1.0 OUTLIER -83.11 156.63 15.02 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 123.372 2.715 . . . . 0.0 112.082 179.696 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.673 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -133.91 37.02 0.35 Allowed Pre-proline 0 C--N 1.327 -0.386 0 CA-C-O 120.987 0.422 . . . . 0.0 110.978 179.817 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.673 ' CD ' ' N ' ' A' ' 39' ' ' THR . 60.5 Cg_endo -72.49 50.77 1.7 Allowed 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.643 2.229 . . . . 0.0 112.171 179.707 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.507 ' N ' HD12 ' A' ' 41' ' ' LEU . 0.2 OUTLIER -164.01 50.54 0.13 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.007 -179.628 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 65.6 -124.52 0.35 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.653 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 61.41 -152.07 0.38 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.737 0.303 . . . . 0.0 110.887 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.468 ' HG2' ' N ' ' A' ' 45' ' ' LYS . 32.7 ttmt -164.99 154.32 12.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.759 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.468 ' N ' ' HG2' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -163.72 153.66 15.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.008 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.619 HG23 ' N ' ' A' ' 47' ' ' MET . 7.3 t -161.63 -145.48 0.11 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.595 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.619 ' N ' HG23 ' A' ' 46' ' ' THR . 3.9 mtt -89.68 27.7 1.46 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.946 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.402 ' C ' ' O ' ' A' ' 47' ' ' MET . 0.8 OUTLIER 38.05 68.29 0.33 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.711 -179.927 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -102.06 168.37 2.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.229 -179.83 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.539 ' O ' ' CB ' ' A' ' 51' ' ' LYS . 5.3 mm-40 49.06 20.01 0.34 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.204 179.685 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.539 ' CB ' ' O ' ' A' ' 50' ' ' GLN . 0.7 OUTLIER 156.74 117.13 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.789 0.328 . . . . 0.0 111.092 179.991 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -141.47 111.65 6.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.531 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -134.43 13.78 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.63 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.429 ' O ' HG23 ' A' ' 54' ' ' THR . 13.9 t -168.66 121.14 0.81 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.149 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 5.7 m -144.0 -168.94 2.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.7 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.5 ' O ' ' CB ' ' A' ' 57' ' ' SER . 2.4 pt-20 -71.51 117.8 13.53 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.081 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 56' ' ' GLU . 0.4 OUTLIER 160.56 154.03 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.52 179.98 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.627 ' O ' ' CB ' ' A' ' 59' ' ' CYS . 65.0 p -150.26 179.35 8.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.275 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.627 ' CB ' ' O ' ' A' ' 58' ' ' THR . 4.5 m 138.62 122.06 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.353 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.552 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 62.7 m -105.81 67.86 0.77 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.419 -179.444 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.606 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -80.94 70.79 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.349 179.394 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.834 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 21.12 111.56 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.435 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.639 ' N ' ' O ' ' A' ' 81' ' ' ALA . 2.5 ttmt -52.04 -36.76 51.33 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 178.223 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.615 ' O ' ' HB1' ' A' ' 62' ' ' ALA . 3.5 m -136.09 178.02 7.38 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.273 -1.331 . . . . 0.0 108.863 179.116 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.707 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 2.7 p90 -158.27 157.09 31.85 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.085 -0.646 . . . . 0.0 112.572 -179.639 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.92 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 0.4 OUTLIER -127.42 24.99 6.17 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-O 122.705 1.24 . . . . 0.0 107.989 176.501 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.684 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 3.3 ptt85 -2.87 120.05 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 112.144 -2.298 . . . . 0.0 112.198 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 1.017 HG21 ' CD1' ' A' ' 25' ' ' ILE . 2.5 m -124.42 45.23 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.504 179.732 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.61 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 94.5 m -20.12 119.55 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 121.17 0.509 . . . . 0.0 110.747 -178.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.88 HG21 ' CE2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -122.88 -164.02 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.005 -179.169 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.736 ' HE1' ' CE1' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -28.3 138.72 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.45 -1.25 . . . . 0.0 111.323 -179.583 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 57.04 11.94 6.68 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.005 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 70' ' ' VAL . . . 74.96 39.29 38.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.141 -179.756 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.61 ' O ' ' HA ' ' A' ' 69' ' ' THR . 12.9 m-85 -73.48 114.51 11.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.95 0.405 . . . . 0.0 111.219 -179.616 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.7 mtmm -95.57 95.81 8.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.734 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.182 HG21 ' CG2' ' A' ' 25' ' ' ILE . 26.8 m -83.59 10.7 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.35 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.544 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.707 ' O ' ' CB ' ' A' ' 65' ' ' TYR . 0.3 OUTLIER 28.15 40.44 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 -177.145 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.92 ' HB3' ' CA ' ' A' ' 66' ' ' ASN . 9.9 t-20 8.96 63.17 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.991 0 CA-C-N 113.932 -1.485 . . . . 0.0 107.42 -175.627 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 1.242 ' O ' HD21 ' A' ' 12' ' ' LEU . 28.5 m170 -37.76 99.8 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.233 0 CA-C-O 122.498 1.142 . . . . 0.0 111.781 -175.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.721 HG23 ' O ' ' A' ' 78' ' ' ASN . 10.2 p -95.9 0.25 51.76 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 113.781 -1.554 . . . . 0.0 111.347 -178.85 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.639 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -167.8 146.81 4.78 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.038 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.862 ' SG ' HD12 ' A' ' 12' ' ' LEU . 84.2 m -120.4 170.19 9.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.827 0.346 . . . . 0.0 111.428 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.552 ' O ' ' HA ' ' A' ' 60' ' ' CYS . 0.3 OUTLIER -175.27 108.91 0.1 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.936 179.717 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.519 ' O ' ' CB ' ' A' ' 85' ' ' SER . 3.2 t -82.48 114.0 20.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.914 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.519 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 0.1 OUTLIER 160.69 179.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.001 0.429 . . . . 0.0 111.391 179.64 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.491 ' O ' ' HB3' ' A' ' 87' ' ' CYS . 0.2 OUTLIER 39.66 -146.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.303 179.886 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.491 ' HB3' ' O ' ' A' ' 86' ' ' THR . 0.0 OUTLIER 77.42 136.13 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.608 -179.728 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 49.42 -141.62 0.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.488 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -155.1 -77.96 0.1 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.681 0.277 . . . . 0.0 111.297 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 15.4 t-160 59.38 100.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.954 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.413 ' C ' ' OG ' ' A' ' 92' ' ' SER . 0.0 OUTLIER -101.77 141.24 34.92 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.111 -179.829 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.413 ' OG ' ' C ' ' A' ' 91' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.145 -0.931 . . . . 0.0 110.991 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 1.069 ' H83' ' CB ' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.748 ' O7 ' ' C3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 183' ' ' NAG . . . . . 0.729 ' H5 ' ' O5 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 186' ' ' GAL . . . . . 0.729 ' O5 ' ' H5 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.873 ' HB3' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.488 1.433 0 CA-C-O 120.625 0.25 . . . . 0.0 111.204 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.873 ' CD ' ' HB3' ' A' ' 1' ' ' ALA . 10.2 Cg_endo -50.11 -34.93 40.51 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.77 2.314 . . . . 0.0 111.808 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -80.96 -41.02 23.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.728 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.514 ' O ' ' CB ' ' A' ' 5' ' ' GLN . 5.5 p -145.79 140.56 21.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.969 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.514 ' CB ' ' O ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER 83.37 57.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.691 -179.891 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.489 ' OD1' ' N ' ' A' ' 6' ' ' ASP . 11.6 p-10 -165.14 25.68 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.196 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.515 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 20.5 p -171.0 78.89 0.54 Allowed Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.797 179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -64.44 67.98 0.24 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.626 2.217 . . . . 0.0 112.469 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.52 ' OE1' ' CE1' ' A' ' 33' ' ' PHE . 0.6 OUTLIER 57.16 -177.61 0.06 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.279 179.782 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.4 ' HB3' ' HB2' ' A' ' 82' ' ' CYS . 88.8 m -71.72 131.82 43.67 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.499 -179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.848 ' O ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -161.59 -131.46 0.02 OUTLIER 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.061 179.625 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.266 HD21 ' O ' ' A' ' 79' ' ' HIS . 8.5 mp -145.74 127.04 14.86 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.865 0.364 . . . . 0.0 111.348 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.585 ' O ' ' C ' ' A' ' 14' ' ' GLU . 2.9 mm-40 -92.81 46.6 1.24 Allowed 'General case' 0 CA--C 1.504 -0.813 0 CA-C-O 121.799 0.809 . . . . 0.0 110.397 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.6 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 4.1 tt0 -0.59 117.63 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 113.522 -1.672 . . . . 0.0 111.419 -178.697 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.834 ' OD1' HG11 ' A' ' 76' ' ' VAL . 0.0 OUTLIER -58.76 103.93 0.39 Allowed Pre-proline 0 C--N 1.306 -1.288 0 CA-C-N 113.957 -1.474 . . . . 0.0 111.214 179.973 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.43 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 3.0 Cg_exo -74.27 14.85 0.68 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.914 2.409 . . . . 0.0 112.167 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.427 ' CE2' ' HG2' ' A' ' 71' ' ' MET . 58.9 t80 -113.42 -50.84 2.84 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.415 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 1.081 ' CD1' HG12 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -79.82 -11.17 59.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.237 -179.549 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.598 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -52.36 104.36 0.09 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.63 -179.391 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.596 ' CG ' ' O ' ' A' ' 18' ' ' PHE . 0.9 OUTLIER -123.14 166.13 19.4 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.581 179.402 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.05 76.99 0.02 OUTLIER 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.703 2.269 . . . . 0.0 112.501 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 119.81 10.23 7.8 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.516 -0.849 . . . . 0.0 112.982 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 1.013 ' CB ' ' H83' ' A' ' 178' ' ' NAG . . . -161.38 98.1 1.28 Allowed Pre-proline 0 CA--C 1.512 -0.504 0 CA-C-O 122.141 0.972 . . . . 0.0 112.227 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.605 ' O ' ' O ' ' A' ' 25' ' ' ILE . 74.2 Cg_endo -106.55 82.45 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.549 1 C-N-CA 125.301 4.001 . . . . 0.0 111.958 -179.356 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.304 ' CG2' HG21 ' A' ' 76' ' ' VAL . 32.8 mm -42.01 -176.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.005 HD13 ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -155.92 -156.97 0.68 Allowed 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 115.028 1.492 . . . . 0.0 115.028 -173.579 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.53 ' HG3' ' O ' ' A' ' 27' ' ' GLN . 1.3 tp-100 160.78 72.19 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 112.637 -2.074 . . . . 0.0 110.575 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.836 ' SG ' ' HB3' ' A' ' 79' ' ' HIS . 73.8 m -21.39 114.15 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.86 -179.078 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.535 ' CE ' ' OE1' ' A' ' 13' ' ' GLN . 7.1 tpp -51.16 -39.69 56.94 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.493 ' O ' ' HB2' ' A' ' 31' ' ' CYS . . . 63.72 119.12 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.997 -0.621 . . . . 0.0 112.876 179.433 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.493 ' HB2' ' O ' ' A' ' 30' ' ' GLY . 24.6 t 176.44 72.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.86 0.362 . . . . 0.0 110.91 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.413 ' HA ' ' OE1' ' A' ' 9' ' ' GLU . 2.8 m -75.98 157.79 32.68 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.16 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.52 ' CE1' ' OE1' ' A' ' 9' ' ' GLU . 34.6 p90 179.15 133.19 0.09 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.14 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 26.7 m 55.78 -173.1 0.06 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.912 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.3 ttt180 -128.41 161.17 30.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.763 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.47 ' O ' ' CD1' ' A' ' 37' ' ' TYR . . . -139.93 63.01 1.5 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.16 0.505 . . . . 0.0 111.047 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.479 ' N ' ' CD ' ' A' ' 38' ' ' PRO . 0.3 OUTLIER -153.01 50.14 0.57 Allowed Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.811 -179.875 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.479 ' CD ' ' N ' ' A' ' 37' ' ' TYR . 7.2 Cg_exo -35.97 130.37 0.35 Allowed 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.359 2.706 . . . . 0.0 112.511 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.472 ' O ' ' O ' ' A' ' 38' ' ' PRO . 11.5 p 54.81 154.61 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.132 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 39' ' ' THR . 29.1 Cg_exo -61.66 160.69 27.48 Favored 'Trans proline' 0 C--O 1.231 0.132 0 C-N-CA 122.94 2.427 . . . . 0.0 112.493 -179.75 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.445 ' O ' ' CB ' ' A' ' 42' ' ' ARG . 37.9 mt -122.61 -137.29 0.31 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.747 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.461 ' O ' ' CB ' ' A' ' 43' ' ' SER . 0.2 OUTLIER 165.59 79.01 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.889 0.376 . . . . 0.0 111.034 179.929 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.461 ' CB ' ' O ' ' A' ' 42' ' ' ARG . 9.2 p 163.94 94.98 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.818 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 52.2 102.27 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.847 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.47 ' HA ' ' HD3' ' A' ' 45' ' ' LYS . 0.2 OUTLIER -69.25 -166.12 0.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.704 179.815 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.411 ' O ' ' C ' ' A' ' 47' ' ' MET . 11.0 p -96.34 147.35 23.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.862 0.363 . . . . 0.0 111.07 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.411 ' C ' ' O ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -36.56 142.55 0.09 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.14 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 65.8 mt -125.56 166.92 15.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.312 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.495 HG12 ' H ' ' A' ' 51' ' ' LYS . 0.9 OUTLIER -51.57 162.55 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.867 -179.915 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.5 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 4.4 pm0 -101.31 48.85 0.88 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.734 -179.211 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.583 ' O ' ' CB ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER 73.55 84.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.677 179.107 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.583 ' CB ' ' O ' ' A' ' 51' ' ' LYS . 1.5 m120 150.89 133.08 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.84 0.353 . . . . 0.0 111.38 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.586 ' O ' HG23 ' A' ' 53' ' ' VAL . 17.0 m -135.25 88.38 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.867 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.498 ' O ' ' HB3' ' A' ' 55' ' ' SER . 15.4 p -140.92 158.16 44.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.905 0.383 . . . . 0.0 111.063 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.498 ' HB3' ' O ' ' A' ' 54' ' ' THR . 21.3 t 75.12 166.74 0.28 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.245 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.486 ' O ' ' O ' ' A' ' 57' ' ' SER . 0.0 OUTLIER -123.96 -161.21 0.97 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.621 179.768 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.486 ' O ' ' O ' ' A' ' 56' ' ' GLU . 25.6 t 54.97 116.72 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.462 -179.712 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.463 ' C ' ' SG ' ' A' ' 59' ' ' CYS . 0.7 OUTLIER -85.64 139.47 31.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.08 0.467 . . . . 0.0 111.825 -179.145 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.493 ' O ' ' O ' ' A' ' 85' ' ' SER . 0.8 OUTLIER -161.79 128.76 3.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.087 179.25 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.501 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 1.2 m -70.36 123.25 21.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.859 0.362 . . . . 0.0 111.639 -179.542 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.828 ' O ' HG12 ' A' ' 61' ' ' VAL . 40.5 t -123.41 63.64 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.675 179.425 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.648 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 32.33 105.59 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.515 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.777 ' N ' ' O ' ' A' ' 81' ' ' ALA . 23.1 tptt -54.49 -42.14 70.4 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.704 0.764 . . . . 0.0 108.946 177.728 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.579 ' O ' ' N ' ' A' ' 80' ' ' THR . 50.0 m -141.94 123.28 14.82 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.577 179.212 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.735 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 0.4 OUTLIER -114.14 158.86 20.73 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.639 0.733 . . . . 0.0 112.93 -177.81 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.944 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -128.55 30.35 5.16 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 176.466 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.687 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -7.6 133.49 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 112.17 -2.286 . . . . 0.0 112.401 -179.35 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 1.043 HG21 HG13 ' A' ' 25' ' ' ILE . 2.4 m -139.47 45.17 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.87 -179.739 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.667 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 21.8 m -10.75 119.18 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.649 -179.368 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 1.081 HG12 ' CD1' ' A' ' 18' ' ' PHE . 4.6 m -120.61 -169.81 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.787 0.804 . . . . 0.0 112.635 -178.721 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.614 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 11.1 mtt 37.12 -125.44 0.19 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.304 -1.317 . . . . 0.0 111.087 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -87.74 36.51 3.35 Favored Glycine 0 N--CA 1.437 -1.29 0 CA-C-N 115.399 -0.819 . . . . 0.0 112.682 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.565 ' C ' HG23 ' A' ' 69' ' ' THR . . . 104.33 21.27 9.5 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.118 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.676 ' CB ' HG22 ' A' ' 70' ' ' VAL . 3.8 m-85 -52.15 -177.84 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.607 0.241 . . . . 0.0 111.01 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.563 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -154.34 106.39 2.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 179.753 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.304 HG21 ' CG2' ' A' ' 25' ' ' ILE . 22.8 m -104.95 12.49 8.14 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.368 0 CA-C-O 121.043 0.449 . . . . 0.0 110.477 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.735 ' O ' ' CB ' ' A' ' 65' ' ' TYR . 0.4 OUTLIER 23.7 43.88 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 -178.282 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.944 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 15.6 t-20 8.2 64.74 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.967 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 -175.535 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 1.266 ' O ' HD21 ' A' ' 12' ' ' LEU . 26.5 m170 -41.36 90.61 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 122.362 1.077 . . . . 0.0 112.437 -175.412 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.667 HG23 ' O ' ' A' ' 78' ' ' ASN . 4.2 p -83.29 -4.32 58.32 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 113.946 -1.479 . . . . 0.0 110.146 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.777 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -176.23 141.04 0.42 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.616 ' SG ' ' O ' ' A' ' 11' ' ' THR . 1.5 m -114.87 151.68 33.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.825 0.345 . . . . 0.0 110.95 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.51 ' O ' ' O ' ' A' ' 84' ' ' CYS . 0.2 OUTLIER -152.48 119.44 5.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.936 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.51 ' O ' ' O ' ' A' ' 83' ' ' HIS . 36.1 m -46.13 -177.7 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.181 -179.707 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.522 ' O ' ' CB ' ' A' ' 86' ' ' THR . 5.2 p 55.48 162.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.703 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.534 ' O ' ' CG2' ' A' ' 61' ' ' VAL . 4.6 m 84.24 100.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.346 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.464 ' HB3' ' HB2' ' A' ' 59' ' ' CYS . 9.8 p 178.05 42.62 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.874 -179.77 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.509 ' O ' ' CD2' ' A' ' 89' ' ' TYR . 0.1 OUTLIER -170.38 -159.73 0.2 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.828 -179.996 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.509 ' CD2' ' O ' ' A' ' 88' ' ' TYR . 0.5 OUTLIER 167.59 34.27 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.496 179.677 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -110.23 177.09 4.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.634 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.439 ' O ' ' OXT' ' A' ' 92' ' ' SER . 5.4 tttp -168.61 -131.02 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.575 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.439 ' OXT' ' O ' ' A' ' 91' ' ' LYS . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.76 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 1.013 ' H83' ' CB ' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.764 ' O7 ' ' C3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 183' ' ' NAG . . . . . 0.752 ' C3 ' ' O7 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.566 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 185' ' ' GAL . . . . . 0.566 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.559 ' HB3' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.843 0.354 . . . . 0.0 111.038 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.559 ' HD3' ' HB3' ' A' ' 1' ' ' ALA . 72.7 Cg_endo -84.15 -62.1 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.849 2.366 . . . . 0.0 112.619 -179.711 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.483 ' OD1' ' HG2' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -119.7 -173.75 2.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.863 0.363 . . . . 0.0 111.104 -179.803 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.623 ' O ' ' CB ' ' A' ' 5' ' ' GLN . 3.0 p 165.42 99.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.626 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.623 ' CB ' ' O ' ' A' ' 4' ' ' VAL . 25.8 tt0 98.46 75.52 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.741 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -150.27 157.97 43.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.659 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.434 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 3.5 p 176.77 138.17 0.21 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.144 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 7' ' ' CYS . 6.2 Cg_exo -76.75 76.23 4.15 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 123.038 2.492 . . . . 0.0 111.888 179.691 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.518 ' HA ' ' O ' ' A' ' 31' ' ' CYS . 4.8 tt0 60.78 150.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.613 -179.65 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.581 ' CB ' ' HA2' ' A' ' 30' ' ' GLY . 28.1 p -30.98 123.94 0.21 Allowed 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.407 179.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.672 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 0.2 OUTLIER -154.47 164.41 38.7 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.457 0.646 . . . . 0.0 111.886 -179.895 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.182 HD21 ' O ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER -67.82 120.31 13.93 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.139 178.553 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.647 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.1 mt-30 -111.0 56.48 0.63 Allowed 'General case' 0 CA--C 1.501 -0.929 0 CA-C-O 122.015 0.912 . . . . 0.0 110.814 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.647 ' O ' ' O ' ' A' ' 13' ' ' GLN . 23.8 tt0 2.91 121.49 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 112.703 -2.044 . . . . 0.0 111.194 -179.617 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.683 ' ND2' ' CD2' ' A' ' 18' ' ' PHE . 1.2 t30 -48.91 99.23 0.21 Allowed Pre-proline 0 C--N 1.306 -1.318 0 CA-C-N 114.455 -1.248 . . . . 0.0 111.697 -179.289 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.596 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 40.4 Cg_endo -66.51 5.0 0.81 Allowed 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 121.88 1.72 . . . . 0.0 109.765 178.031 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.612 ' CZ ' ' SD ' ' A' ' 71' ' ' MET . 0.6 OUTLIER -103.65 -56.93 2.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 113.883 -1.508 . . . . 0.0 110.514 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.683 ' CD2' ' ND2' ' A' ' 15' ' ' ASN . 0.6 OUTLIER -87.63 -2.33 58.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.007 -179.666 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.774 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.3 m -60.0 86.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.645 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.756 ' CG ' ' HB3' ' A' ' 23' ' ' ALA . 3.4 pt20 -108.67 154.37 41.72 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.788 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -57.14 66.74 0.04 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.23 0 C-N-CA 122.563 2.175 . . . . 0.0 111.232 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.631 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 149.56 -15.36 1.09 Allowed Glycine 0 N--CA 1.449 -0.438 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.681 -179.031 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.764 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -148.21 99.39 3.68 Favored Pre-proline 0 CA--C 1.51 -0.576 0 CA-C-O 122.007 0.908 . . . . 0.0 110.822 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.774 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 62.5 Cg_endo -104.57 66.36 0.02 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.692 0 C-N-CA 124.718 3.612 . . . . 0.0 113.755 -178.052 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.149 ' CG2' HG21 ' A' ' 76' ' ' VAL . 15.4 mm -39.75 -179.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 N-CA-C 112.789 0.662 . . . . 0.0 112.789 179.174 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.001 ' HB3' HD23 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -148.52 -163.01 1.68 Allowed 'General case' 0 CA--C 1.497 -1.078 0 CA-C-O 122.624 1.202 . . . . 0.0 113.992 -176.073 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.586 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 8.6 tp60 167.77 62.66 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 112.501 -2.136 . . . . 0.0 111.005 179.439 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.672 ' HA ' ' O ' ' A' ' 11' ' ' THR . 1.2 t -28.74 99.72 0.02 OUTLIER 'General case' 0 C--O 1.23 0.075 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.065 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.575 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 19.0 tpp -58.24 -117.49 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.037 -179.017 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.581 ' HA2' ' CB ' ' A' ' 10' ' ' CYS . . . 172.54 121.45 0.6 Allowed Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.35 -0.929 . . . . 0.0 112.796 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.518 ' O ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -152.74 49.31 0.74 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.168 0.509 . . . . 0.0 110.467 179.593 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.74 112.07 7.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.73 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -102.36 -139.45 0.35 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.003 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 95.3 p -71.4 -176.9 1.63 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.973 0.416 . . . . 0.0 111.488 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.464 ' CZ ' ' CB ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -127.2 -162.78 1.19 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.887 -179.923 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 64.65 107.97 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.878 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.425 ' HA ' ' HD2' ' A' ' 38' ' ' PRO . 3.4 m-30 -83.94 120.48 74.98 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.998 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.425 ' HD2' ' HA ' ' A' ' 37' ' ' TYR . 11.7 Cg_endo -55.79 111.84 0.88 Allowed 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.649 2.233 . . . . 0.0 111.923 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.587 ' CG2' ' HD2' ' A' ' 40' ' ' PRO . 23.3 m -116.16 143.91 31.9 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.796 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.729 ' O ' HD12 ' A' ' 41' ' ' LEU . 49.1 Cg_exo -34.66 140.31 0.09 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.692 2.262 . . . . 0.0 112.429 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.729 HD12 ' O ' ' A' ' 40' ' ' PRO . 1.5 mp 82.63 -54.46 0.2 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.788 -179.53 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.551 ' O ' ' O ' ' A' ' 41' ' ' LEU . 15.7 ptt180 52.23 125.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.166 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -134.54 132.35 39.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.951 -179.743 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.58 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -85.67 80.12 9.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.908 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 3.0 ttmp? -84.67 69.78 10.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.0 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.62 ' O ' ' CB ' ' A' ' 47' ' ' MET . 15.4 t -89.78 -161.29 0.77 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.921 0.391 . . . . 0.0 111.065 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.626 ' O ' ' CB ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER 145.0 -36.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.876 -179.731 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.626 ' CB ' ' O ' ' A' ' 47' ' ' MET . 0.1 OUTLIER 142.45 -167.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.875 179.97 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.427 HG23 ' C ' ' A' ' 48' ' ' LEU . 2.8 t 68.17 142.61 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.679 0.276 . . . . 0.0 110.659 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -175.46 66.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.784 0.326 . . . . 0.0 111.229 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -113.98 37.81 3.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.824 179.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.491 ' CG ' ' O ' ' A' ' 52' ' ' ASN . 8.4 t-20 -84.94 15.35 4.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.81 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.446 ' O ' ' C ' ' A' ' 54' ' ' THR . 0.6 OUTLIER -170.48 134.21 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.954 179.949 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.498 HG21 HG23 ' A' ' 86' ' ' THR . 0.2 OUTLIER -34.65 -64.52 0.25 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.035 -179.863 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -157.82 175.72 13.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.002 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -75.83 76.79 2.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.778 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.23 63.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.799 179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.499 HG22 ' HA ' ' A' ' 85' ' ' SER . 0.6 OUTLIER -86.74 143.76 27.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.913 179.946 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.8 p -147.08 134.75 21.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.957 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.511 ' SG ' ' CB ' ' A' ' 84' ' ' CYS . 83.8 m -88.81 125.05 34.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.315 -179.67 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.68 HG13 ' O ' ' A' ' 61' ' ' VAL . 11.4 p -126.43 71.12 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.047 179.43 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.64 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 24.54 106.88 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.456 -179.344 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.804 ' N ' ' O ' ' A' ' 81' ' ' ALA . 9.7 ttmm -55.25 -42.66 73.78 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 177.905 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.512 ' N ' ' HB3' ' A' ' 81' ' ' ALA . 0.7 OUTLIER -136.9 136.81 38.98 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.251 -1.341 . . . . 0.0 108.901 178.989 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.692 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 6.2 p90 -126.2 160.94 28.87 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.141 0.496 . . . . 0.0 112.264 -178.045 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.89 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 1.2 t30 -126.08 27.03 6.39 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-O 122.51 1.148 . . . . 0.0 107.945 176.547 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.594 ' HG3' ' HA ' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -9.57 122.94 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 112.466 -2.152 . . . . 0.0 111.367 -179.46 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.958 HG21 ' CD1' ' A' ' 25' ' ' ILE . 2.4 m -119.47 40.81 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.186 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.707 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 48.0 m -18.08 118.39 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.282 -179.246 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.906 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.2 OUTLIER -131.76 -167.37 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-O 121.608 0.718 . . . . 0.0 112.215 -178.544 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.634 ' H ' HG12 ' A' ' 70' ' ' VAL . 0.0 OUTLIER 42.32 -131.57 0.53 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.755 -179.839 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -83.7 36.5 2.82 Favored Glycine 0 N--CA 1.435 -1.394 0 CA-C-N 115.263 -0.881 . . . . 0.0 112.099 179.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 94.55 47.0 2.84 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.034 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.707 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.5 m-85 -78.28 178.53 7.57 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.657 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -155.59 110.18 2.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.984 0.421 . . . . 0.0 111.669 -179.876 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.149 HG21 ' CG2' ' A' ' 25' ' ' ILE . 10.1 m -107.5 10.59 9.12 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.416 0 CA-C-O 121.288 0.566 . . . . 0.0 109.686 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.772 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER 28.54 40.12 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 -177.601 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.89 ' HB3' ' CA ' ' A' ' 66' ' ' ASN . 13.9 t-20 5.95 62.26 0.0 OUTLIER 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 -176.105 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 1.182 ' O ' HD21 ' A' ' 12' ' ' LEU . 28.4 m170 -37.17 103.67 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.252 0 CA-C-O 122.409 1.1 . . . . 0.0 112.026 -175.239 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.76 HG23 ' O ' ' A' ' 78' ' ' ASN . 7.8 p -102.44 -5.58 23.92 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 113.777 -1.556 . . . . 0.0 111.32 -178.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.804 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -167.2 135.34 2.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.639 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 15.6 m -115.84 155.14 28.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.832 0.349 . . . . 0.0 111.095 -179.109 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.488 ' O ' ' HA ' ' A' ' 60' ' ' CYS . 2.3 p-80 -159.78 116.76 2.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.964 0.411 . . . . 0.0 111.075 179.534 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.525 ' O ' ' HB2' ' A' ' 85' ' ' SER . 0.5 OUTLIER -73.48 137.72 44.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.972 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.561 ' OG ' ' N ' ' A' ' 86' ' ' THR . 17.0 t 163.99 -165.78 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.979 179.687 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.561 ' N ' ' OG ' ' A' ' 85' ' ' SER . 25.1 p -49.65 -178.79 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.064 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 52.6 m -154.12 92.66 1.55 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.687 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -113.79 132.99 55.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.891 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.456 ' O ' ' HB2' ' A' ' 90' ' ' HIS . 0.4 OUTLIER -153.47 -76.16 0.12 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.928 179.804 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.456 ' HB2' ' O ' ' A' ' 89' ' ' TYR . 66.3 t-80 178.69 158.85 0.54 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.163 -179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -95.4 127.59 41.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.993 -179.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.7 t . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.19 -0.91 . . . . 0.0 110.999 180.0 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 0.954 ' H82' HD11 ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.554 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 180' ' ' BMA . . . . . 0.61 ' O2 ' ' H5 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 181' ' ' MAN . . . . . 0.61 ' H5 ' ' O2 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 183' ' ' NAG . . . . . 0.81 ' H3 ' ' O7 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.65 ' H5 ' ' O5 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 185' ' ' GAL . . . . . 0.65 ' O5 ' ' H5 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.771 ' HB3' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.937 0.398 . . . . 0.0 110.996 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.771 ' CD ' ' HB3' ' A' ' 1' ' ' ALA . 14.9 Cg_exo -35.13 134.51 0.18 Allowed 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 123.217 2.611 . . . . 0.0 112.359 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -106.8 -53.97 2.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.936 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.418 ' C ' ' HG2' ' A' ' 5' ' ' GLN . 0.5 OUTLIER -74.89 151.72 6.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.88 0.371 . . . . 0.0 111.07 179.958 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.418 ' HG2' ' C ' ' A' ' 4' ' ' VAL . 1.2 mm-40 -138.15 -155.05 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.964 -179.594 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.519 ' OD1' ' N ' ' A' ' 6' ' ' ASP . 0.3 OUTLIER -55.42 -170.4 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.688 179.89 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.429 ' C ' ' SG ' ' A' ' 31' ' ' CYS . 12.2 t -178.75 76.28 0.21 Allowed Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.859 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.461 ' HG2' ' HA2' ' A' ' 30' ' ' GLY . 70.2 Cg_endo -74.45 158.76 43.98 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.643 2.229 . . . . 0.0 112.467 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.471 ' HA ' ' CE1' ' A' ' 33' ' ' PHE . 0.3 OUTLIER -49.36 124.33 9.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.888 179.947 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.57 ' HB2' ' C ' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -58.88 126.62 28.42 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.058 -179.901 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.648 ' O ' ' N ' ' A' ' 29' ' ' MET . 9.2 t 176.29 -175.04 0.11 Allowed 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.098 179.559 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.853 HD23 HD13 ' A' ' 26' ' ' LEU . 4.6 mp -79.76 136.72 36.82 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.554 -179.532 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.629 ' O ' ' O ' ' A' ' 14' ' ' GLU . 42.9 mt-30 -115.39 60.53 0.7 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.212 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.629 ' O ' ' O ' ' A' ' 13' ' ' GLN . 20.9 tt0 2.8 121.2 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.752 -179.504 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.864 ' OD1' HG11 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -51.71 113.07 3.67 Favored Pre-proline 0 C--N 1.306 -1.311 0 CA-C-N 113.866 -1.515 . . . . 0.0 112.139 -179.668 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_endo -79.86 18.16 1.18 Allowed 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.418 2.079 . . . . 0.0 111.607 178.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.574 ' CD2' ' SD ' ' A' ' 71' ' ' MET . 15.6 t80 -124.88 -55.28 1.61 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.487 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 1.213 ' CD1' HG12 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -73.03 -16.17 61.5 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.829 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.489 ' HB3' ' O ' ' A' ' 15' ' ' ASN . 4.2 p -49.18 88.05 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.627 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.599 ' O ' ' N ' ' A' ' 22' ' ' GLY . 4.3 mt-30 -113.58 160.21 32.57 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.063 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.14 67.21 0.03 OUTLIER 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.757 2.304 . . . . 0.0 112.19 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.599 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 144.54 -5.45 1.58 Allowed Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.811 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.935 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -153.46 105.32 2.56 Favored Pre-proline 0 CA--C 1.515 -0.376 0 CA-C-O 122.006 0.907 . . . . 0.0 111.858 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.672 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.4 Cg_endo -102.95 68.26 0.03 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.457 0 C-N-CA 124.904 3.736 . . . . 0.0 112.528 -179.332 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.216 ' CG2' HG21 ' A' ' 76' ' ' VAL . 24.4 mm -39.82 -174.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -179.648 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.035 HD23 ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -153.63 -159.21 0.95 Allowed 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -174.858 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.492 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 1.9 tt0 160.16 101.61 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 112.661 -2.063 . . . . 0.0 110.062 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.55 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -47.11 103.71 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.115 -179.005 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.648 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.6 OUTLIER -120.23 140.77 50.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.935 179.726 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.461 ' HA2' ' HG2' ' A' ' 8' ' ' PRO . . . 134.38 -135.88 8.25 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.711 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.57 ' C ' ' HB2' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -158.87 136.29 10.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.795 0.331 . . . . 0.0 110.908 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 50.5 t -73.41 73.66 1.38 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.34 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.471 ' CE1' ' HA ' ' A' ' 9' ' ' GLU . 24.1 p90 -121.23 -173.9 2.72 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.62 179.599 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -173.85 148.96 1.49 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.896 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.3 mmt85 -40.96 131.83 2.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.775 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.485 ' O ' ' CB ' ' A' ' 37' ' ' TYR . . . -74.28 117.05 15.65 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.108 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.485 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 5.8 t80 161.87 123.4 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.738 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.453 ' O ' ' C ' ' A' ' 39' ' ' THR . 10.2 Cg_endo -53.42 170.69 0.35 Allowed 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.775 2.316 . . . . 0.0 112.098 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.453 ' C ' ' O ' ' A' ' 38' ' ' PRO . 81.7 p 33.84 64.77 1.51 Allowed Pre-proline 0 C--N 1.331 -0.214 0 CA-C-O 121.076 0.465 . . . . 0.0 110.524 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -71.82 173.52 12.58 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.86 2.373 . . . . 0.0 112.69 -179.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.46 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 4.0 mm? -61.92 121.25 12.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.918 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.46 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -151.25 72.58 1.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.98 -179.798 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 30.6 t -166.02 -94.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.633 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.49 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -54.88 104.83 0.13 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.142 179.409 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.868 ' HG2' HG22 ' A' ' 46' ' ' THR . 10.9 ttpt -179.88 -30.03 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.182 -179.389 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.868 HG22 ' HG2' ' A' ' 45' ' ' LYS . 0.2 OUTLIER 175.07 -35.39 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.729 -179.987 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -165.08 168.47 17.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.818 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.463 HD23 ' HA ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -85.77 79.67 9.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.814 0.34 . . . . 0.0 111.08 179.956 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.451 ' O ' ' O ' ' A' ' 48' ' ' LEU . 31.5 t 56.44 151.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.168 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.454 ' O ' ' C ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -129.53 156.42 44.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.707 179.88 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.454 ' C ' ' O ' ' A' ' 50' ' ' GLN . 0.2 OUTLIER -33.09 115.47 0.2 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.886 179.985 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -79.25 -167.42 1.18 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.506 ' O ' ' C ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -144.86 112.58 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.628 179.908 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.608 HG23 ' H ' ' A' ' 55' ' ' SER . 3.1 t -26.04 -58.94 0.08 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.414 -179.654 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.608 ' H ' HG23 ' A' ' 54' ' ' THR . 1.4 t 155.83 121.01 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.927 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.486 ' N ' ' OE1' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -150.58 83.73 1.36 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.806 179.869 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 62.74 -152.35 0.35 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.812 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.655 ' O ' ' CB ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER 179.4 -177.09 0.3 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.063 179.944 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.726 ' O ' HG22 ' A' ' 61' ' ' VAL . 27.3 t 107.33 132.92 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.893 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.2 m -55.32 121.48 9.0 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.008 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.726 HG22 ' O ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER -146.83 76.17 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.57 179.872 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.661 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . -5.71 102.73 0.01 OUTLIER 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 122.071 0.938 . . . . 0.0 112.317 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.858 ' HG3' ' C ' ' A' ' 81' ' ' ALA . 0.1 OUTLIER -50.8 -44.85 59.05 Favored 'General case' 0 CA--C 1.49 -1.33 0 CA-C-N 113.613 -1.63 . . . . 0.0 108.597 178.028 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.678 ' O ' ' N ' ' A' ' 80' ' ' THR . 37.2 m -138.96 112.48 8.25 Favored 'General case' 0 N--CA 1.425 -1.677 0 CA-C-N 113.625 -1.625 . . . . 0.0 110.395 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.696 ' CG ' ' CG ' ' A' ' 77' ' ' GLU . 0.9 OUTLIER -99.66 164.25 12.14 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.843 -178.823 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.795 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -134.65 29.16 3.56 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 177.317 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.563 ' O ' ' O ' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -6.18 129.98 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 112.099 -2.319 . . . . 0.0 112.487 -179.678 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 1.049 HG21 HG13 ' A' ' 25' ' ' ILE . 3.2 m -141.04 47.31 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.593 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.677 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 20.1 m -6.92 118.64 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.138 -179.075 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 1.213 HG12 ' CD1' ' A' ' 18' ' ' PHE . 5.4 m -119.01 -169.48 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.867 0.841 . . . . 0.0 112.851 -178.728 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.593 ' HG2' HG23 ' A' ' 70' ' ' VAL . 3.0 mmt 34.51 -127.86 0.09 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.212 -1.358 . . . . 0.0 111.517 179.619 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -83.02 35.81 2.73 Favored Glycine 0 N--CA 1.44 -1.06 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.585 -179.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.527 ' C ' HG23 ' A' ' 69' ' ' THR . . . 103.33 19.24 12.74 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.869 -0.682 . . . . 0.0 112.027 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.738 ' HB2' ' CG2' ' A' ' 70' ' ' VAL . 3.0 m-85 -52.03 -176.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.656 0.265 . . . . 0.0 111.038 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.582 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 18.9 mtmm -153.36 94.85 1.86 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.902 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.216 HG21 ' CG2' ' A' ' 25' ' ' ILE . 31.7 m -86.44 10.77 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.359 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.633 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.727 ' O ' ' HD2' ' A' ' 79' ' ' HIS . 0.1 OUTLIER 26.46 42.01 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 105.666 -1.975 . . . . 0.0 105.666 -177.632 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.95 ' HB2' HG13 ' A' ' 68' ' ' VAL . 51.6 t30 -0.86 69.98 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.846 0 CA-C-N 113.51 -1.677 . . . . 0.0 109.16 -174.209 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 1.031 ' N ' HD12 ' A' ' 26' ' ' LEU . 41.3 m170 -43.34 111.76 0.31 Allowed 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 113.472 -1.694 . . . . 0.0 113.5 -176.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.678 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.5 p -91.71 -33.58 14.98 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 113.731 -1.577 . . . . 0.0 108.413 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.858 ' C ' ' HG3' ' A' ' 63' ' ' LYS . . . -149.55 150.04 31.64 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 177.798 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.9 OUTLIER -129.35 130.41 46.04 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.075 0.464 . . . . 0.0 111.674 -179.612 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.645 ' HB3' ' HD2' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -131.99 131.38 42.49 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.615 -179.718 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 66.6 m -65.24 102.07 0.62 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.222 178.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.559 ' N ' ' O ' ' A' ' 59' ' ' CYS . 0.7 OUTLIER -156.2 174.7 15.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.728 -179.616 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.514 ' O ' HG11 ' A' ' 61' ' ' VAL . 0.5 OUTLIER -33.93 129.12 0.35 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.153 -179.922 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.426 ' CB ' HG13 ' A' ' 61' ' ' VAL . 1.0 OUTLIER -146.41 161.92 39.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.855 -179.998 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -103.36 143.91 32.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.734 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 11.2 m-30 -69.76 57.5 0.14 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.861 0.362 . . . . 0.0 110.836 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.591 ' O ' ' C ' ' A' ' 91' ' ' LYS . 1.3 t-160 -109.01 -53.21 2.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.705 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.591 ' C ' ' O ' ' A' ' 90' ' ' HIS . 0.0 OUTLIER -1.44 72.86 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.908 179.938 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.541 ' N ' ' O ' ' A' ' 90' ' ' HIS . 16.8 m . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.769 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 0.935 ' H83' ' HB1' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.757 ' O7 ' ' C3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 180' ' ' BMA . . . . . 0.595 ' H4 ' ' O5 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 181' ' ' MAN . . . . . 0.499 ' H3 ' ' O4 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 182' ' ' MAN . . . . . 0.595 ' O5 ' ' H4 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 183' ' ' NAG . . . . . 0.733 ' C3 ' ' O7 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.683 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 185' ' ' GAL . . . . . 0.683 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.892 0.377 . . . . 0.0 110.951 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -77.68 97.38 1.14 Allowed 'Trans proline' 0 N--CA 1.464 -0.224 0 C-N-CA 122.769 2.313 . . . . 0.0 112.251 179.997 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -120.61 163.71 17.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.756 179.868 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.51 ' O ' ' N ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -127.39 70.13 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.224 -179.845 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' A' ' 5' ' ' GLN . 12.9 pt20 -64.01 64.0 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.713 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.528 ' OD1' ' N ' ' A' ' 6' ' ' ASP . 4.9 p-10 -177.55 101.93 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.839 -179.81 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.463 ' N ' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER 34.28 60.31 2.08 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.114 179.968 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.605 ' O ' ' CA ' ' A' ' 30' ' ' GLY . 52.3 Cg_exo -54.06 107.17 0.2 Allowed 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 122.345 2.03 . . . . 0.0 111.612 179.53 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.484 ' C ' ' O ' ' A' ' 8' ' ' PRO . 7.6 tt0 -28.33 116.25 0.09 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.407 -179.631 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.537 ' HA ' ' HA3' ' A' ' 30' ' ' GLY . 1.8 t -48.12 118.96 2.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.575 179.965 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.43 ' OG1' ' O ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER 176.06 162.14 0.34 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.218 -179.538 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.888 HD21 ' O ' ' A' ' 79' ' ' HIS . 6.0 mp -54.66 130.86 41.92 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.977 178.912 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.671 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.8 mm-40 -127.57 62.31 1.38 Allowed 'General case' 0 CA--C 1.506 -0.727 0 CA-C-O 122.357 1.075 . . . . 0.0 111.734 -179.853 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.686 ' O ' ' HD3' ' A' ' 16' ' ' PRO . 0.9 OUTLIER 6.46 125.87 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 112.241 -2.254 . . . . 0.0 112.295 179.538 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.772 ' ND2' HG11 ' A' ' 76' ' ' VAL . 0.5 OUTLIER -56.15 100.2 0.21 Allowed Pre-proline 0 C--N 1.314 -0.944 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.889 179.782 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.686 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 66.0 Cg_endo -72.86 4.81 3.35 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 121.738 1.625 . . . . 0.0 109.315 177.342 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.542 ' CD2' ' CE1' ' A' ' 18' ' ' PHE . 1.1 t80 -106.02 -57.87 1.99 Allowed 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 113.724 -1.58 . . . . 0.0 110.364 -179.839 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.945 ' CG ' HG21 ' A' ' 70' ' ' VAL . 3.6 m-30 -81.58 0.67 37.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.622 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.49 102.95 0.6 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.012 179.899 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.607 ' HB3' ' HD2' ' A' ' 21' ' ' PRO . 12.9 mt-30 -111.54 162.21 22.02 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.286 179.607 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.607 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 24.9 Cg_endo -60.47 66.37 0.08 OUTLIER 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.647 2.232 . . . . 0.0 111.812 179.773 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.537 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 147.14 -10.96 1.37 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.345 -179.623 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 1.105 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -146.89 106.38 3.95 Favored Pre-proline 0 CA--C 1.514 -0.441 0 CA-C-O 121.858 0.837 . . . . 0.0 111.349 -179.662 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.569 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 97.3 Cg_endo -104.03 75.44 0.03 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.573 0 C-N-CA 124.752 3.634 . . . . 0.0 113.083 -178.48 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.268 ' CG2' HG21 ' A' ' 76' ' ' VAL . 15.5 mm -44.47 -175.35 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.911 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.003 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -146.04 -166.36 2.44 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 -176.026 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.534 ' O ' ' C ' ' A' ' 28' ' ' CYS . 1.7 tt0 164.32 75.17 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 112.501 -2.136 . . . . 0.0 111.993 178.735 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.707 ' SG ' HD12 ' A' ' 12' ' ' LEU . 14.1 m -23.53 101.0 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.709 179.211 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.3 ttt -119.22 146.85 44.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.894 -179.388 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.605 ' CA ' ' O ' ' A' ' 8' ' ' PRO . . . 144.3 -163.06 27.87 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.929 179.846 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.416 ' O ' ' SG ' ' A' ' 31' ' ' CYS . 6.9 p -128.03 124.77 37.96 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.811 0.338 . . . . 0.0 110.786 -179.812 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.6 t -79.19 123.65 27.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.768 179.985 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -157.97 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.748 179.868 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.529 ' O ' ' C ' ' A' ' 35' ' ' ARG . 26.0 p -104.12 59.72 0.72 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.575 179.656 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.529 ' C ' ' O ' ' A' ' 34' ' ' SER . 2.8 tmm_? -24.5 133.72 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.228 -179.712 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -116.71 115.81 26.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.861 179.813 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER 60.44 85.86 0.17 Allowed Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.838 -179.972 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.441 ' HD3' ' NH1' ' A' ' 35' ' ' ARG . 94.2 Cg_exo -43.05 137.78 4.45 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.694 2.263 . . . . 0.0 112.324 179.952 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 62.3 p -52.52 152.02 6.98 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.139 -179.742 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.8 164.21 32.26 Favored 'Trans proline' 0 N--CA 1.465 -0.155 0 C-N-CA 122.925 2.417 . . . . 0.0 112.408 -179.97 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.493 ' O ' ' O ' ' A' ' 42' ' ' ARG . 1.3 pp -162.83 -26.42 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.171 179.803 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.493 ' O ' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -45.32 178.88 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.764 0.316 . . . . 0.0 110.851 -179.97 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.463 ' OG ' ' N ' ' A' ' 44' ' ' LYS . 87.0 p -118.32 -99.31 0.44 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.338 -179.809 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.463 ' N ' ' OG ' ' A' ' 43' ' ' SER . 3.5 ttmt -132.02 41.14 3.28 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.761 0.315 . . . . 0.0 111.174 -179.696 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.583 ' C ' HG22 ' A' ' 46' ' ' THR . 9.1 ttmt 66.06 174.67 0.23 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.931 179.753 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.64 ' OG1' ' N ' ' A' ' 47' ' ' MET . 0.1 OUTLIER 178.2 -169.34 0.09 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.842 -179.994 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.64 ' N ' ' OG1' ' A' ' 46' ' ' THR . 0.0 OUTLIER -34.91 160.33 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.12 179.914 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.448 ' C ' ' O ' ' A' ' 47' ' ' MET . 1.2 tt -30.88 129.93 0.12 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.406 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.9 m -97.61 144.57 10.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.056 179.733 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.31 -172.23 2.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.868 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.9 tttt -97.89 141.1 31.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.927 -179.827 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.95 94.55 0.75 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.723 179.907 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 5.6 p -160.24 139.45 3.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.284 -179.852 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.423 ' O ' ' CB ' ' A' ' 55' ' ' SER . 73.3 p -65.98 -82.94 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.963 179.86 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.423 ' CB ' ' O ' ' A' ' 54' ' ' THR . 6.2 p 166.03 -166.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.424 -179.862 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -72.37 55.75 0.34 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.792 0.33 . . . . 0.0 110.916 179.869 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.1 p -147.74 122.8 10.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.724 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.437 HG22 ' HB2' ' A' ' 85' ' ' SER . 0.0 OUTLIER -130.71 156.95 44.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.119 -179.732 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.431 ' SG ' ' C ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -172.11 139.98 1.14 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.752 179.69 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.443 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 96.6 m -70.91 126.21 28.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.324 -179.604 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.761 HG22 ' O ' ' A' ' 61' ' ' VAL . 2.2 p -143.72 65.52 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.214 179.331 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.594 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 10.64 104.29 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.073 -179.224 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 1.046 ' N ' ' O ' ' A' ' 81' ' ' ALA . 70.4 tttt -53.35 -36.29 61.18 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 178.148 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.468 ' N ' ' HB3' ' A' ' 81' ' ' ALA . 8.0 m -139.08 163.01 33.54 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.326 -1.306 . . . . 0.0 108.558 178.867 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.764 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.7 OUTLIER -144.57 159.29 43.04 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.616 -179.236 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.878 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 0.9 OUTLIER -124.28 24.83 7.94 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 122.677 1.227 . . . . 0.0 107.817 176.88 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.551 ' O ' ' O ' ' A' ' 66' ' ' ASN . 3.9 ttt180 1.0 121.53 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 111.997 -2.365 . . . . 0.0 112.04 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 1.003 HG21 ' CD1' ' A' ' 25' ' ' ILE . 1.5 m -128.27 39.81 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.893 179.668 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.664 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 47.8 m -21.45 118.61 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.062 -179.454 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.945 HG21 ' CG ' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -121.29 -168.87 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.775 0.797 . . . . 0.0 112.636 -178.767 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.473 ' HB2' ' CD2' ' A' ' 74' ' ' PHE . 61.0 mmm 30.17 -131.45 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.127 -1.397 . . . . 0.0 111.571 -179.918 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -63.04 -0.39 3.03 Favored Glycine 0 N--CA 1.442 -0.923 0 CA-C-N 115.342 -0.845 . . . . 0.0 113.271 -179.694 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.532 ' N ' ' O ' ' A' ' 70' ' ' VAL . . . 119.62 37.11 0.8 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.156 -179.782 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.664 ' O ' ' HA ' ' A' ' 69' ' ' THR . 32.2 m-85 -64.08 -178.67 0.36 Allowed 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.498 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.619 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -153.87 95.13 1.84 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -179.576 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.268 HG21 ' CG2' ' A' ' 25' ' ' ILE . 14.1 m -92.15 16.89 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.494 -1.201 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.323 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.764 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 22.38 45.12 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 -177.934 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.878 ' HB3' ' CA ' ' A' ' 66' ' ' ASN . 9.0 t-20 3.16 71.13 0.0 OUTLIER 'General case' 0 CA--C 1.498 -1.041 0 CA-C-N 114.407 -1.269 . . . . 0.0 107.601 -175.226 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 1.003 ' N ' HD12 ' A' ' 26' ' ' LEU . 33.2 m170 -41.99 115.06 0.61 Allowed 'General case' 0 C--N 1.304 -1.383 0 CA-C-O 122.372 1.082 . . . . 0.0 111.475 -176.277 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.786 HG23 ' O ' ' A' ' 78' ' ' ASN . 11.0 p -114.02 -2.83 13.42 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 113.779 -1.555 . . . . 0.0 110.761 -178.578 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 1.046 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -168.35 112.48 0.61 Allowed 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.79 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.525 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.5 OUTLIER -99.87 153.96 18.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.692 0.282 . . . . 0.0 110.838 -179.284 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.738 ' NE2' HG13 ' A' ' 61' ' ' VAL . 1.6 p80 -161.69 113.59 1.75 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.942 0.401 . . . . 0.0 111.092 -179.975 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.684 ' O ' ' CB ' ' A' ' 85' ' ' SER . 0.1 OUTLIER -72.41 111.12 7.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.701 179.946 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.684 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 13.5 t 136.9 164.75 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.095 179.942 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.407 ' CB ' ' O ' ' A' ' 85' ' ' SER . 3.2 m 77.78 69.16 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.118 179.875 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 1.6 m -117.04 135.78 53.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.273 -179.923 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 5.0 m-30 -89.91 49.76 1.77 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.405 179.477 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -169.29 -177.3 2.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.3 -179.724 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.437 ' O ' ' CG ' ' A' ' 90' ' ' HIS . 0.0 OUTLIER -147.63 119.86 8.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.92 0.39 . . . . 0.0 111.113 -179.878 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.59 79.06 0.27 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.086 179.881 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 71.1 m . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.715 179.828 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 1.105 ' H83' ' HB1' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.576 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 180' ' ' BMA . . . . . 0.997 ' H62' ' H5 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 181' ' ' MAN . . . . . 0.575 ' O2 ' ' O7 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 182' ' ' MAN . . . . . 0.997 ' H5 ' ' H62' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 183' ' ' NAG . . . . . 0.865 ' H4 ' ' O2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.575 ' O7 ' ' O2 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 185' ' ' GAL . . . . . 0.574 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 186' ' ' GAL . . . . . 0.865 ' O2 ' ' H4 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.456 ' HB1' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.867 0.365 . . . . 0.0 110.921 . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.597 ' O ' ' C ' ' A' ' 3' ' ' ASP . 20.7 Cg_exo -65.53 -156.48 0.03 OUTLIER 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.87 2.38 . . . . 0.0 111.98 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.597 ' C ' ' O ' ' A' ' 2' ' ' PRO . 0.4 OUTLIER 4.82 110.09 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.684 179.854 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.588 HG12 ' H ' ' A' ' 6' ' ' ASP . 89.7 t -100.14 144.44 12.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.108 0.48 . . . . 0.0 111.805 -179.544 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.464 ' O ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -136.31 36.6 2.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.142 179.473 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.588 ' H ' HG12 ' A' ' 4' ' ' VAL . 0.2 OUTLIER -53.35 -158.38 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.493 -179.401 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.484 ' C ' ' O ' ' A' ' 6' ' ' ASP . 1.2 p -25.25 144.82 0.03 OUTLIER Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.87 -179.567 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -57.81 -157.73 0.01 OUTLIER 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 123.154 2.569 . . . . 0.0 112.515 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.963 ' O ' HG22 ' A' ' 11' ' ' THR . 2.3 tt0 -89.81 130.48 36.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.32 -179.737 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.414 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -32.49 130.45 0.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.547 179.987 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.963 HG22 ' O ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -170.34 -160.42 0.22 Allowed 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.157 179.201 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.281 HD21 ' O ' ' A' ' 79' ' ' HIS . 0.8 OUTLIER -74.98 135.77 41.33 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.462 -179.224 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.635 ' O ' ' O ' ' A' ' 14' ' ' GLU . 6.8 mt-30 -122.18 54.15 1.19 Allowed 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 121.715 0.769 . . . . 0.0 109.707 177.808 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.635 ' O ' ' O ' ' A' ' 13' ' ' GLN . 5.0 tt0 -2.93 125.66 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 113.495 -1.684 . . . . 0.0 111.445 -178.546 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.754 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.5 OUTLIER -62.16 106.0 0.74 Allowed Pre-proline 0 C--N 1.309 -1.173 0 CA-C-N 114.335 -1.302 . . . . 0.0 112.274 -179.176 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.407 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 4.3 Cg_exo -77.19 10.88 2.25 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 122.531 2.154 . . . . 0.0 109.415 177.453 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.564 ' CE1' ' SD ' ' A' ' 71' ' ' MET . 0.9 OUTLIER -106.48 -61.15 1.56 Allowed 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.138 -1.392 . . . . 0.0 111.296 -179.196 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.811 ' CG ' HG21 ' A' ' 70' ' ' VAL . 5.2 m-85 -81.72 -3.22 53.14 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.714 -178.718 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.707 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 58.4 p -58.75 89.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.974 0.416 . . . . 0.0 110.723 -179.886 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.589 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -88.57 165.99 25.18 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.933 179.731 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.453 ' CD ' ' HG3' ' A' ' 20' ' ' GLN . 22.6 Cg_endo -61.43 59.02 0.11 Allowed 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 122.348 2.032 . . . . 0.0 111.452 179.638 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.589 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 157.39 -16.53 0.34 Allowed Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 115.773 -0.648 . . . . 0.0 112.622 -179.534 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 1.14 ' CB ' ' H83' ' A' ' 178' ' ' NAG . . . -145.22 109.25 4.6 Favored Pre-proline 0 CA--C 1.517 -0.324 0 CA-C-O 121.966 0.889 . . . . 0.0 112.168 -179.316 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.89 ' HD2' ' H3 ' ' A' ' 178' ' ' NAG . 69.0 Cg_endo -101.81 78.81 0.04 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.284 0 C-N-CA 124.912 3.741 . . . . 0.0 113.401 -179.086 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.185 ' CG2' HG21 ' A' ' 76' ' ' VAL . 5.6 mm -39.18 -176.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.992 HD13 ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -152.98 -160.12 1.09 Allowed 'General case' 0 CA--C 1.503 -0.856 0 CA-C-O 122.509 1.147 . . . . 0.0 113.955 -175.974 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.565 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 2.4 tt0 162.75 78.24 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 112.853 -1.976 . . . . 0.0 111.339 179.392 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.802 ' HA ' ' O ' ' A' ' 11' ' ' THR . 77.1 m -25.52 100.24 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.174 179.885 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.831 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.0 OUTLIER -136.07 146.08 46.67 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.942 179.8 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.76 -151.23 20.95 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.591 -179.971 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.438 ' O ' ' SG ' ' A' ' 31' ' ' CYS . 31.4 p -147.73 80.5 1.49 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.726 0.298 . . . . 0.0 110.936 179.99 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.574 ' O ' ' CD1' ' A' ' 33' ' ' PHE . 0.3 OUTLIER -37.78 -83.59 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.869 179.815 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 32' ' ' CYS . 35.7 m-85 -162.23 -38.51 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.961 -179.847 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.604 ' O ' HG23 ' A' ' 58' ' ' THR . 0.0 OUTLIER -111.54 116.97 31.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.941 179.883 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.436 ' O ' ' O ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -118.89 -162.21 0.89 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.997 179.836 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.436 ' O ' ' O ' ' A' ' 35' ' ' ARG . . . 45.35 -174.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.115 -179.808 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.582 ' CD1' ' O ' ' A' ' 37' ' ' TYR . 0.4 OUTLIER -102.78 124.42 38.95 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.847 179.937 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.93 179.67 0.71 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.781 2.32 . . . . 0.0 112.391 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.459 ' O ' ' OG1' ' A' ' 39' ' ' THR . 0.1 OUTLIER -114.97 101.13 54.44 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.875 179.965 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -87.5 -161.29 0.12 Allowed 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.082 2.521 . . . . 0.0 112.06 179.819 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.517 ' O ' ' N ' ' A' ' 43' ' ' SER . 4.8 mt -107.44 27.5 9.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.912 179.95 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.446 ' HD2' ' C ' ' A' ' 41' ' ' LEU . 0.8 OUTLIER 61.48 -73.71 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.993 0.425 . . . . 0.0 110.592 -179.899 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.523 ' O ' ' CB ' ' A' ' 44' ' ' LYS . 0.1 OUTLIER 51.14 -157.43 0.11 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.281 179.642 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' A' ' 43' ' ' SER . 0.1 OUTLIER 86.65 57.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.566 -179.634 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.423 ' H ' ' HG3' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -68.74 -157.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.876 -179.876 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.4 78.9 1.65 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.832 179.826 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -170.13 130.11 0.94 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.001 -179.861 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.69 74.82 2.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.212 -179.8 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.51 HG22 ' O ' ' A' ' 49' ' ' VAL . 0.7 OUTLIER -116.18 120.11 63.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.659 179.691 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.44 ' HG2' ' C ' ' A' ' 49' ' ' VAL . 0.1 OUTLIER -148.27 145.43 28.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.941 0.4 . . . . 0.0 111.194 -179.885 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.448 ' HB2' ' CG2' ' A' ' 53' ' ' VAL . 7.2 mmtp -137.81 23.53 2.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.78 179.9 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 54.7 36.44 26.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.735 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.457 ' O ' HG23 ' A' ' 54' ' ' THR . 1.5 t -96.82 162.51 2.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.95 179.92 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 53' ' ' VAL . 0.0 OUTLIER 176.36 -169.43 0.06 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.869 179.969 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.506 ' O ' ' O ' ' A' ' 56' ' ' GLU . 8.6 m -144.6 -57.4 0.36 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.984 -179.911 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.506 ' O ' ' O ' ' A' ' 55' ' ' SER . 1.0 OUTLIER 49.58 109.46 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.506 -179.709 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.486 ' C ' ' O ' ' A' ' 56' ' ' GLU . 0.3 OUTLIER -31.05 -82.83 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.837 -179.836 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.604 HG23 ' O ' ' A' ' 34' ' ' SER . 4.7 p -76.53 -177.28 4.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.538 179.597 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.645 ' O ' ' O ' ' A' ' 83' ' ' HIS . 1.8 t -152.62 28.28 0.55 Allowed 'General case' 0 CA--C 1.508 -0.642 0 CA-C-O 121.572 0.701 . . . . 0.0 111.356 -179.927 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.697 ' O ' HG23 ' A' ' 61' ' ' VAL . 33.5 m -62.5 -167.33 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.371 -1.286 . . . . 0.0 110.617 179.488 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.79 ' O ' HG12 ' A' ' 61' ' ' VAL . 56.7 t 116.45 62.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.041 -179.535 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.818 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 10.23 108.36 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.514 -0.766 . . . . 0.0 112.196 -179.621 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.821 ' N ' ' O ' ' A' ' 81' ' ' ALA . 36.5 tttt -51.81 -33.36 35.41 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.582 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.54 ' O ' ' HB1' ' A' ' 62' ' ' ALA . 13.8 m -141.3 165.3 27.89 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.943 179.075 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.656 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 0.3 OUTLIER -147.22 161.83 40.14 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.239 0.542 . . . . 0.0 111.936 -179.356 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.806 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.1 OUTLIER -134.5 29.59 3.57 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-O 122.74 1.257 . . . . 0.0 107.698 176.787 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.555 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -9.76 128.73 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 112.029 -2.35 . . . . 0.0 112.163 -179.458 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 1.038 HG21 ' CD1' ' A' ' 25' ' ' ILE . 4.3 m -136.06 48.35 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 114.812 -1.086 . . . . 0.0 110.282 179.883 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.605 ' C ' ' O ' ' A' ' 68' ' ' VAL . 89.1 m -20.08 118.27 0.03 OUTLIER 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.048 -179.304 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.811 HG21 ' CG ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -120.48 -172.05 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-O 121.428 0.632 . . . . 0.0 112.525 -178.039 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.564 ' SD ' ' CE1' ' A' ' 17' ' ' PHE . 29.0 mmm 33.2 -127.64 0.06 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.791 -1.095 . . . . 0.0 111.147 -179.275 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -78.71 9.88 34.38 Favored Glycine 0 N--CA 1.438 -1.218 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.651 -179.817 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.555 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 128.68 24.76 1.08 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.763 179.969 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.567 ' O ' ' HA ' ' A' ' 69' ' ' THR . 5.7 m-30 -69.7 118.49 12.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.796 0.331 . . . . 0.0 110.999 -179.791 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.442 ' HB3' ' CD ' ' A' ' 67' ' ' ARG . 0.4 OUTLIER -105.87 110.64 23.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.071 0.462 . . . . 0.0 111.892 -179.668 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.185 HG21 ' CG2' ' A' ' 25' ' ' ILE . 17.7 m -95.21 12.05 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.439 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.44 178.958 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.72 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER 29.69 39.34 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 105.47 -2.048 . . . . 0.0 105.47 -176.636 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.874 ' C ' HD12 ' A' ' 26' ' ' LEU . 55.3 t30 3.11 64.11 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.682 0 CA-C-N 113.341 -1.754 . . . . 0.0 108.405 -174.562 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 1.281 ' O ' HD21 ' A' ' 12' ' ' LEU . 35.8 m170 -38.0 114.05 0.32 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 113.399 -1.728 . . . . 0.0 112.818 -176.689 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.54 ' OG1' ' CB ' ' A' ' 64' ' ' SER . 3.0 p -98.54 -7.3 28.53 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 114.388 -1.278 . . . . 0.0 110.339 -179.734 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.821 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -169.32 136.8 1.8 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.89 178.741 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.915 ' SG ' HD12 ' A' ' 12' ' ' LEU . 6.9 m -119.67 119.37 33.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.653 0.263 . . . . 0.0 110.636 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.645 ' O ' ' O ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER -109.2 106.7 16.67 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.917 0.389 . . . . 0.0 110.156 178.996 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.499 ' HB2' ' SG ' ' A' ' 60' ' ' CYS . 15.5 t -123.99 163.43 21.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.007 -179.387 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.633 ' O ' ' C ' ' A' ' 86' ' ' THR . 0.0 OUTLIER 66.47 -175.91 0.19 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.305 -179.759 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.633 ' C ' ' O ' ' A' ' 85' ' ' SER . 11.9 m 7.67 85.64 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.299 179.841 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.668 ' O ' ' HB2' ' A' ' 88' ' ' TYR . 59.9 m -65.38 59.53 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.961 0.41 . . . . 0.0 110.823 -179.725 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.668 ' HB2' ' O ' ' A' ' 87' ' ' CYS . 17.9 t80 156.21 21.96 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.4 179.889 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.611 ' O ' ' CG ' ' A' ' 89' ' ' TYR . 1.2 p90 -48.14 111.31 0.43 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.982 -179.703 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.494 ' O ' ' HB3' ' A' ' 91' ' ' LYS . 7.2 t-160 -64.06 -74.94 0.09 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.695 179.91 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.494 ' HB3' ' O ' ' A' ' 90' ' ' HIS . 0.0 OUTLIER 166.63 -37.58 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.113 -179.998 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.759 179.879 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 1.14 ' H83' ' CB ' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.565 ' O7 ' ' O3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 183' ' ' NAG . . . . . 0.44 ' H3 ' ' O7 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.672 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 185' ' ' GAL . . . . . 0.672 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.876 ' HB3' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.487 1.407 0 CA-C-O 120.705 0.288 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.876 ' CD ' ' HB3' ' A' ' 1' ' ' ALA . 1.4 Cg_endo -43.4 -54.06 3.83 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.864 2.376 . . . . 0.0 111.999 179.751 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.587 ' CB ' ' O ' ' A' ' 2' ' ' PRO . 16.1 t0 94.9 90.55 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.41 179.581 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.675 HG23 ' N ' ' A' ' 5' ' ' GLN . 13.2 m 24.42 -142.43 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.866 179.528 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.675 ' N ' HG23 ' A' ' 4' ' ' VAL . 20.2 tt0 -124.04 62.59 1.08 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.909 -179.78 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.475 ' O ' ' OD1' ' A' ' 6' ' ' ASP . 38.8 p30 -132.41 149.66 52.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.039 179.914 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.453 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 11.2 t -35.75 123.41 0.67 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.874 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.545 ' O ' ' O ' ' A' ' 9' ' ' GLU . 32.0 Cg_exo -58.97 78.55 0.05 OUTLIER 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 123.123 2.549 . . . . 0.0 113.563 -179.121 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.545 ' O ' ' O ' ' A' ' 8' ' ' PRO . 6.9 tt0 48.59 162.75 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.155 0.502 . . . . 0.0 112.013 178.65 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.424 ' SG ' ' HA2' ' A' ' 30' ' ' GLY . 11.3 t -56.71 132.29 51.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.171 179.943 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.67 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -149.16 -148.18 0.25 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.624 179.673 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.947 HD23 HD13 ' A' ' 26' ' ' LEU . 3.3 mp -116.21 141.23 48.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.002 0.43 . . . . 0.0 111.034 179.825 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.735 ' CG ' ' HA ' ' A' ' 29' ' ' MET . 2.7 mt-30 -98.93 45.75 1.0 Allowed 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 121.292 0.568 . . . . 0.0 110.896 179.778 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.653 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 0.9 OUTLIER -5.92 117.92 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.835 -178.729 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.796 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.5 OUTLIER -58.26 103.53 0.37 Allowed Pre-proline 0 C--N 1.304 -1.378 0 CA-C-N 114.063 -1.426 . . . . 0.0 112.455 -178.659 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.558 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 86.2 Cg_endo -77.4 4.36 5.99 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 122.119 1.879 . . . . 0.0 109.289 177.4 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.607 ' CE2' ' SD ' ' A' ' 71' ' ' MET . 0.8 OUTLIER -95.08 -64.41 1.07 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 113.659 -1.61 . . . . 0.0 109.742 179.563 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.831 ' CG ' HG21 ' A' ' 70' ' ' VAL . 7.8 m-85 -74.82 -4.4 37.55 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.994 179.339 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.61 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -57.69 88.57 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.542 179.856 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.723 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.8 OUTLIER -95.3 155.9 38.3 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.057 179.715 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -48.98 69.04 0.02 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.726 2.284 . . . . 0.0 111.754 179.709 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.723 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 137.25 -0.45 2.87 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.77 -179.572 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 1.023 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -153.94 104.39 2.47 Favored Pre-proline 0 CA--C 1.517 -0.311 0 CA-C-O 121.806 0.812 . . . . 0.0 112.178 -179.551 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.622 ' HD2' ' H3 ' ' A' ' 178' ' ' NAG . 63.2 Cg_endo -104.64 76.64 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 125.133 3.889 . . . . 0.0 113.491 -178.725 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.167 ' CG2' HG21 ' A' ' 76' ' ' VAL . 10.1 mm -40.64 -173.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 179.728 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.027 HD23 ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -151.51 -162.73 1.59 Allowed 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -176.298 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.648 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 35.7 tp60 168.18 50.97 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 113.099 -1.864 . . . . 0.0 111.967 179.55 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.605 ' O ' ' O ' ' A' ' 27' ' ' GLN . 0.8 OUTLIER 26.55 119.14 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 178.705 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.735 ' HA ' ' CG ' ' A' ' 13' ' ' GLN . 1.9 ttp -68.0 -67.97 0.42 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.304 177.921 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.424 ' HA2' ' SG ' ' A' ' 10' ' ' CYS . . . 85.95 100.54 0.74 Allowed Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.931 -0.652 . . . . 0.0 113.205 179.425 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' A' ' 33' ' ' PHE . 11.2 p -162.3 54.44 0.22 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.956 0.408 . . . . 0.0 110.173 179.494 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.2 m -62.88 64.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.991 -179.661 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.535 ' N ' ' O ' ' A' ' 31' ' ' CYS . 15.2 m-30 49.34 -170.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.949 -179.993 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.499 ' HB2' ' O ' ' A' ' 33' ' ' PHE . 0.1 OUTLIER 81.85 -15.19 0.73 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.545 -179.533 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.46 114.51 24.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.605 179.839 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -134.12 25.63 3.89 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.922 0.391 . . . . 0.0 111.368 -179.8 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.552 ' CD1' ' N ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -93.73 124.85 55.59 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.817 179.849 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.478 ' HB2' ' HD2' ' A' ' 40' ' ' PRO . 71.6 Cg_endo -87.94 167.84 6.86 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 122.921 2.414 . . . . 0.0 112.355 179.982 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.571 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -55.66 -57.46 21.11 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-O 121.869 0.842 . . . . 0.0 110.569 179.713 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.571 ' HD3' ' CB ' ' A' ' 39' ' ' THR . 88.6 Cg_endo -80.56 141.34 13.86 Favored 'Trans proline' 0 C--N 1.325 -0.709 0 C-N-CA 124.182 3.255 . . . . 0.0 112.306 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.507 ' O ' ' C ' ' A' ' 42' ' ' ARG . 0.4 OUTLIER -110.09 169.34 8.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.756 179.996 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.515 ' O ' ' N ' ' A' ' 44' ' ' LYS . 4.6 ttp180 -27.59 103.78 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.987 -179.876 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.477 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 1.5 m -64.16 58.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.017 -179.941 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 42' ' ' ARG . 60.1 mttm -161.82 143.45 11.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.664 -179.839 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.74 -170.16 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.65 179.78 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 38.61 63.54 0.87 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.127 179.772 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.413 ' H ' ' HG2' ' A' ' 47' ' ' MET . 2.0 ptp -95.4 158.08 15.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.052 179.895 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.18 174.35 5.99 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.225 -179.694 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.495 ' CG1' ' N ' ' A' ' 50' ' ' GLN . 2.0 t -143.56 158.05 16.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.085 -179.919 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.495 ' N ' ' CG1' ' A' ' 49' ' ' VAL . 0.1 OUTLIER 71.16 125.4 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.935 179.828 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 0.9 OUTLIER 171.16 116.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.175 179.846 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -157.99 -164.97 1.62 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.879 179.646 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.469 ' O ' ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -148.26 103.38 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.537 -179.936 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.469 ' O ' ' O ' ' A' ' 53' ' ' VAL . 9.0 m 56.1 124.31 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.09 179.661 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.422 ' OG ' ' C ' ' A' ' 54' ' ' THR . 0.0 OUTLIER 176.14 165.58 0.41 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.868 179.91 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.555 ' O ' ' CB ' ' A' ' 57' ' ' SER . 0.2 OUTLIER -120.04 -58.3 1.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.801 179.976 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 56' ' ' GLU . 1.8 m 156.73 -22.09 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.079 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.48 ' O ' ' CB ' ' A' ' 59' ' ' CYS . 18.0 p 48.41 178.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.79 -179.793 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.523 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 2.2 p 162.26 141.92 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.176 179.823 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.582 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -124.42 89.93 3.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.257 -179.748 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.59 HG11 ' NE2' ' A' ' 90' ' ' HIS . 2.2 m -77.29 64.0 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.83 179.715 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.66 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 26.11 106.88 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.749 0 CA-C-O 121.993 0.902 . . . . 0.0 112.471 -179.969 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.883 ' HG3' ' CB ' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -49.46 -47.14 48.57 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 113.724 -1.58 . . . . 0.0 107.708 177.023 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.642 ' OG ' ' HB3' ' A' ' 81' ' ' ALA . 2.1 p -128.52 156.19 43.67 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 113.193 -1.822 . . . . 0.0 109.243 179.304 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.704 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -141.31 160.81 39.34 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.59 0.709 . . . . 0.0 112.424 -178.308 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.785 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -127.87 28.32 5.6 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-O 122.703 1.239 . . . . 0.0 107.684 177.378 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.524 ' HD3' ' HB3' ' A' ' 75' ' ' LYS . 0.9 OUTLIER -9.23 126.27 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 112.115 -2.311 . . . . 0.0 112.033 -179.688 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.993 HG21 HG13 ' A' ' 25' ' ' ILE . 3.1 m -129.55 43.03 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.212 179.466 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.577 ' C ' ' O ' ' A' ' 68' ' ' VAL . 53.9 m -16.16 118.95 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.136 -179.303 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.831 HG21 ' CG ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -125.75 -169.23 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.856 -179.574 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.607 ' SD ' ' CE2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER 41.91 -135.57 0.3 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.977 -1.011 . . . . 0.0 110.862 -179.704 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -78.94 21.14 4.13 Favored Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.667 179.935 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 114.88 41.09 0.86 Allowed Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.296 -179.982 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.562 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 3.2 m-85 -70.21 -175.73 1.03 Allowed 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 179.894 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.585 ' N ' ' CD ' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -160.15 94.39 1.1 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -179.552 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.167 HG21 ' CG2' ' A' ' 25' ' ' ILE . 31.4 m -88.98 11.8 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.491 -1.309 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.014 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.758 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 27.14 42.35 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 105.336 -2.098 . . . . 0.0 105.336 -176.81 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.914 ' HB2' HG13 ' A' ' 68' ' ' VAL . 57.4 t30 -1.69 67.21 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.828 0 CA-C-N 113.302 -1.772 . . . . 0.0 108.597 -174.414 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 1.016 ' N ' HD12 ' A' ' 26' ' ' LEU . 37.6 m170 -34.27 122.33 0.49 Allowed 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 112.747 -2.024 . . . . 0.0 114.094 -176.493 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.554 ' OG1' ' CB ' ' A' ' 64' ' ' SER . 6.5 p -107.68 -34.25 7.05 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 113.483 -1.69 . . . . 0.0 109.513 178.362 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.883 ' CB ' ' HG3' ' A' ' 63' ' ' LYS . . . -143.17 143.41 31.78 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.808 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.578 ' CA ' ' HG2' ' A' ' 63' ' ' LYS . 1.2 m -129.6 129.86 44.92 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.943 -179.318 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.818 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 0.3 OUTLIER -120.05 105.91 11.48 Favored 'General case' 0 CA--C 1.522 -0.108 0 CA-C-O 121.07 0.462 . . . . 0.0 111.08 179.278 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.523 ' HA ' ' O ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER -81.29 143.55 32.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.595 179.83 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.405 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 4.5 p 168.76 -174.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.019 0.438 . . . . 0.0 111.277 179.991 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.423 ' O ' ' N ' ' A' ' 88' ' ' TYR . 23.9 p -48.1 126.83 11.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.855 -179.886 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.412 ' O ' ' CD1' ' A' ' 88' ' ' TYR . 1.3 m -67.82 64.45 0.08 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.704 179.758 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.462 ' O ' ' HB2' ' A' ' 89' ' ' TYR . 2.7 m-85 -155.1 142.47 19.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.025 -179.876 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.462 ' HB2' ' O ' ' A' ' 88' ' ' TYR . 3.2 m-85 66.84 75.77 0.31 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.015 179.974 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.59 ' NE2' HG11 ' A' ' 61' ' ' VAL . 7.6 m80 -72.93 -40.29 65.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.591 179.869 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.493 ' C ' ' O ' ' A' ' 90' ' ' HIS . 4.0 mmtt 27.28 70.61 0.05 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.233 -179.993 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.0 p . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.253 -0.88 . . . . 0.0 111.01 -179.994 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 1.023 ' H83' ' HB1' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.517 ' N2 ' ' H61' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.513 ' H5 ' ' O5 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 185' ' ' GAL . . . . . 0.513 ' O5 ' ' H5 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.853 0.359 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -87.16 -42.63 0.05 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 123.111 2.541 . . . . 0.0 112.759 -179.738 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -119.97 42.39 2.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.194 -179.632 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.1 m -148.34 174.26 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.941 179.831 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.444 ' OE1' ' HA ' ' A' ' 5' ' ' GLN . 2.4 mm-40 -161.23 47.77 0.21 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.099 -179.943 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.595 ' O ' ' C ' ' A' ' 7' ' ' CYS . 1.9 t70 77.5 -170.05 0.06 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.047 179.859 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.595 ' C ' ' O ' ' A' ' 6' ' ' ASP . 8.8 p -2.65 113.8 0.01 OUTLIER Pre-proline 0 N--CA 1.464 0.234 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.813 -179.788 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.423 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 49.2 Cg_exo -56.11 80.11 0.03 OUTLIER 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.954 2.436 . . . . 0.0 112.365 179.958 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.557 ' O ' ' HB2' ' A' ' 10' ' ' CYS . 0.0 OUTLIER 167.72 -178.69 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.886 -179.896 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.629 ' H ' ' HA3' ' A' ' 30' ' ' GLY . 0.0 OUTLIER 83.73 94.17 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.535 -179.71 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.881 ' O ' HD12 ' A' ' 12' ' ' LEU . 1.2 t -158.53 -125.43 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.148 -179.837 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.895 HD23 HD13 ' A' ' 26' ' ' LEU . 11.1 mp -133.55 129.95 37.77 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.001 0.429 . . . . 0.0 110.919 179.644 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.655 ' O ' ' O ' ' A' ' 14' ' ' GLU . 28.1 mt-30 -106.64 55.51 0.66 Allowed 'General case' 0 CA--C 1.504 -0.824 0 CA-C-O 121.444 0.64 . . . . 0.0 111.717 -179.083 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.655 ' O ' ' O ' ' A' ' 13' ' ' GLN . 26.1 tt0 0.03 122.66 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 113.872 -1.513 . . . . 0.0 111.279 -179.611 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.845 ' ND2' ' CZ ' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -51.44 104.34 0.42 Allowed Pre-proline 0 C--N 1.303 -1.422 0 CA-C-N 113.916 -1.493 . . . . 0.0 112.826 -179.116 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.695 ' HD2' ' CE1' ' A' ' 17' ' ' PHE . 55.3 Cg_endo -69.27 7.7 0.81 Allowed 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.161 1.908 . . . . 0.0 112.121 178.943 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.845 ' CZ ' ' ND2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -112.42 -58.95 2.07 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.22 178.778 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.867 ' CD2' HG13 ' A' ' 70' ' ' VAL . 0.4 OUTLIER -71.34 -17.03 62.46 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.556 -178.929 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.575 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -51.13 84.07 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.965 -179.606 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.57 ' O ' ' N ' ' A' ' 22' ' ' GLY . 11.4 mm100 -118.51 159.93 41.91 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.06 -179.855 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.474 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 12.9 Cg_endo -55.3 72.84 0.03 OUTLIER 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.868 2.379 . . . . 0.0 111.515 179.298 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.57 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 142.92 -13.35 2.39 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.961 -0.637 . . . . 0.0 111.903 -179.344 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.486 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -150.55 102.22 3.09 Favored Pre-proline 0 CA--C 1.511 -0.525 0 CA-C-O 122.023 0.916 . . . . 0.0 111.826 -179.79 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.665 ' O ' ' O ' ' A' ' 25' ' ' ILE . 87.3 Cg_endo -104.18 60.47 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.543 0 C-N-CA 124.873 3.715 . . . . 0.0 112.433 -179.112 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.168 ' CG2' HG21 ' A' ' 76' ' ' VAL . 19.9 mm -38.63 -175.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-N 114.916 -1.038 . . . . 0.0 113.544 -179.839 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.071 HD23 ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.13 -160.85 1.2 Allowed 'General case' 0 CA--C 1.503 -0.862 0 CA-C-O 122.398 1.094 . . . . 0.0 113.699 -174.99 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.571 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 16.6 tt0 163.63 66.2 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 113.179 -1.828 . . . . 0.0 111.261 179.298 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.683 ' HA ' ' O ' ' A' ' 11' ' ' THR . 38.9 t -18.96 115.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.573 179.874 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.511 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 0.6 OUTLIER -140.36 92.35 2.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.354 179.629 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.629 ' HA3' ' H ' ' A' ' 10' ' ' CYS . . . -156.7 -144.96 4.07 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.904 -179.384 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.559 ' O ' ' HB2' ' A' ' 32' ' ' CYS . 11.8 t -30.35 152.79 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.875 0.369 . . . . 0.0 111.178 -179.948 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.559 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 61.3 m 79.54 10.97 1.36 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.599 -179.766 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.625 ' CE2' ' HA2' ' A' ' 30' ' ' GLY . 0.0 OUTLIER -99.39 15.59 25.82 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.872 179.61 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.504 ' O ' ' N ' ' A' ' 36' ' ' ALA . 2.3 p -131.55 -35.08 1.32 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.855 179.813 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.468 ' C ' ' O ' ' A' ' 34' ' ' SER . 0.1 OUTLIER -30.08 91.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.267 -179.912 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.559 ' O ' ' C ' ' A' ' 37' ' ' TYR . . . 176.58 34.34 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.159 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.559 ' C ' ' O ' ' A' ' 36' ' ' ALA . 58.9 m-85 -17.65 133.17 0.03 OUTLIER Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.606 179.954 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.471 ' O ' ' O ' ' A' ' 37' ' ' TYR . 73.9 Cg_exo -51.09 -165.93 0.0 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.584 2.189 . . . . 0.0 111.636 179.44 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.525 ' OG1' ' CB ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER 175.19 176.51 0.22 Allowed Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 121.019 0.438 . . . . 0.0 111.24 179.811 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.472 ' CD ' HG22 ' A' ' 39' ' ' THR . 73.8 Cg_endo -84.91 -68.23 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.924 2.416 . . . . 0.0 112.928 -179.691 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.9 mt -83.93 -7.19 59.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.351 -179.57 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.525 ' CB ' ' OG1' ' A' ' 39' ' ' THR . 0.0 OUTLIER -71.58 130.27 40.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.897 -179.992 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.461 ' HB2' ' OG1' ' A' ' 46' ' ' THR . 0.2 OUTLIER -127.6 -178.51 4.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.134 -179.963 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.5 mttt -60.57 -82.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.937 -179.92 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.29 -7.08 8.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.043 -179.894 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.461 ' OG1' ' HB2' ' A' ' 43' ' ' SER . 0.0 OUTLIER -57.68 134.58 56.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.826 -179.953 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.698 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER 68.0 9.12 6.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.601 -179.634 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.698 HD12 ' O ' ' A' ' 47' ' ' MET . 0.0 OUTLIER 45.49 -173.25 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.285 179.728 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.439 ' O ' ' O ' ' A' ' 50' ' ' GLN . 2.4 m -143.58 164.25 15.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.906 -179.942 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.439 ' O ' ' O ' ' A' ' 49' ' ' VAL . 1.9 mm-40 -36.57 157.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.785 179.868 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.35 164.93 12.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.917 179.918 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.505 ' O ' ' O ' ' A' ' 53' ' ' VAL . 10.5 t-20 61.67 81.93 0.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.102 -179.964 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.505 ' O ' ' O ' ' A' ' 52' ' ' ASN . 18.7 m 35.52 -162.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.429 179.856 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.51 ' O ' ' O ' ' A' ' 55' ' ' SER . 0.2 OUTLIER -176.3 87.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.999 -179.838 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.51 ' O ' ' O ' ' A' ' 54' ' ' THR . 0.1 OUTLIER 35.1 99.36 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.077 179.921 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -117.28 155.75 28.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.172 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.472 ' O ' ' HA ' ' A' ' 85' ' ' SER . 0.0 OUTLIER -134.12 -41.89 0.81 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.64 179.742 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.561 HG22 ' HB2' ' A' ' 85' ' ' SER . 0.6 OUTLIER -95.53 167.03 11.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.687 179.649 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.594 ' C ' ' HA ' ' A' ' 84' ' ' CYS . 1.8 p 168.65 103.5 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.089 0.471 . . . . 0.0 112.179 179.686 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.616 ' O ' ' SG ' ' A' ' 82' ' ' CYS . 0.8 OUTLIER -88.96 47.99 1.57 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.444 178.894 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.65 ' O ' ' O ' ' A' ' 62' ' ' ALA . 31.0 m -76.22 65.66 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.241 179.312 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.65 ' O ' ' O ' ' A' ' 61' ' ' VAL . . . 24.06 107.93 0.0 OUTLIER 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.976 -178.621 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.795 ' N ' ' O ' ' A' ' 81' ' ' ALA . 1.2 ttmt -51.38 -36.24 42.43 Favored 'General case' 0 CA--C 1.503 -0.855 0 CA-C-O 121.797 0.808 . . . . 0.0 109.452 179.614 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.591 ' OG ' ' HB3' ' A' ' 81' ' ' ALA . 2.0 p -143.84 142.16 30.7 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.193 -1.367 . . . . 0.0 109.044 178.864 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.672 ' CG ' ' CG ' ' A' ' 77' ' ' GLU . 1.1 p90 -129.54 165.92 20.72 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.672 0.749 . . . . 0.0 112.601 -178.775 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.789 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -133.96 27.48 3.9 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 114.401 -1.272 . . . . 0.0 107.76 176.688 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.674 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -6.86 121.91 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 112.077 -2.329 . . . . 0.0 112.053 179.911 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 1.055 HG21 ' CD1' ' A' ' 25' ' ' ILE . 3.8 m -129.16 44.12 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.055 179.516 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.71 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 36.6 m -18.09 118.0 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.68 -178.799 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.867 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -110.92 -163.42 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.772 0.796 . . . . 0.0 111.812 179.538 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.644 ' HG3' ' CD2' ' A' ' 74' ' ' PHE . 2.4 ptm -34.14 145.57 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.393 -1.276 . . . . 0.0 111.519 -179.555 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 54.3 10.56 2.01 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.659 -0.782 . . . . 0.0 111.977 -179.532 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.501 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 80.68 33.84 29.62 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.192 -179.854 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.71 ' O ' ' HA ' ' A' ' 69' ' ' THR . 9.6 m-85 -65.44 110.29 2.62 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.988 0.423 . . . . 0.0 111.016 -179.873 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.498 ' CD ' ' OG1' ' A' ' 69' ' ' THR . 9.6 mmmt -94.1 98.48 11.02 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.525 -179.837 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.168 HG21 ' CG2' ' A' ' 25' ' ' ILE . 30.1 m -87.53 10.98 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.489 -1.381 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.136 179.149 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.783 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER 27.45 41.43 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 -177.396 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 1.01 ' HB2' HG13 ' A' ' 68' ' ' VAL . 45.0 t30 -0.67 64.95 0.0 OUTLIER 'General case' 0 CA--C 1.501 -0.916 0 CA-C-N 113.371 -1.741 . . . . 0.0 108.542 -174.48 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 1.001 ' N ' HD12 ' A' ' 26' ' ' LEU . 36.9 m170 -37.12 122.05 0.84 Allowed 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 112.75 -2.023 . . . . 0.0 113.746 -176.503 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.573 ' OG1' ' HB2' ' A' ' 64' ' ' SER . 2.6 p -108.29 -8.86 15.59 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 113.504 -1.68 . . . . 0.0 109.622 178.718 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.795 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -173.99 137.52 0.57 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.81 179.001 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.616 ' SG ' ' O ' ' A' ' 60' ' ' CYS . 1.8 t -127.7 131.26 49.79 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.7 0.286 . . . . 0.0 111.164 179.855 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.732 ' ND1' ' HB2' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -142.91 116.95 9.43 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.642 -179.821 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.632 ' O ' ' CB ' ' A' ' 85' ' ' SER . 0.0 OUTLIER -91.95 117.81 30.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.49 179.627 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.632 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 6.9 t 98.04 54.74 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.617 -179.532 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.489 ' O ' ' OG1' ' A' ' 86' ' ' THR . 0.1 OUTLIER -156.97 35.73 0.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.362 -179.849 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 93.3 m -96.11 -168.8 1.81 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.27 -179.644 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.443 ' O ' ' HB3' ' A' ' 89' ' ' TYR . 1.2 t80 -91.05 -153.37 0.31 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.34 -179.645 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.525 ' O ' ' CB ' ' A' ' 90' ' ' HIS . 80.0 t80 67.06 132.21 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.224 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.525 ' CB ' ' O ' ' A' ' 89' ' ' TYR . 0.7 OUTLIER 85.19 116.83 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.051 179.664 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.461 ' O ' ' C ' ' A' ' 92' ' ' SER . 0.1 OUTLIER -173.81 141.02 0.79 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.042 179.865 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.461 ' C ' ' O ' ' A' ' 91' ' ' LYS . 15.1 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.986 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 0.709 ' H82' HD11 ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.636 ' O7 ' ' H3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 180' ' ' BMA . . . . . 0.474 ' H61' ' H2 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 182' ' ' MAN . . . . . 0.474 ' H2 ' ' H61' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 183' ' ' NAG . . . . . 0.591 ' H4 ' ' O2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.776 ' H3 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 185' ' ' GAL . . . . . 0.776 ' O2 ' ' H3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 186' ' ' GAL . . . . . 0.591 ' O2 ' ' H4 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.964 ' HB3' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.713 0.292 . . . . 0.0 111.301 . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.964 ' HD3' ' HB3' ' A' ' 1' ' ' ALA . 76.8 Cg_exo -38.75 -31.5 0.24 Allowed 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.939 2.426 . . . . 0.0 112.849 -179.768 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.445 ' OD2' ' HG3' ' A' ' 8' ' ' PRO . 0.3 OUTLIER -114.29 90.02 3.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.843 0.354 . . . . 0.0 111.249 -179.572 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.7 t -50.21 116.78 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.571 179.647 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 64.33 166.99 0.16 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.327 -179.681 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 73.17 135.22 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.334 -179.586 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.622 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 0.5 OUTLIER -107.22 103.97 50.39 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.242 0.544 . . . . 0.0 111.664 -179.479 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.534 ' HD2' ' HE3' ' A' ' 29' ' ' MET . 5.7 Cg_endo -86.06 161.62 10.17 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.349 2.7 . . . . 0.0 111.857 179.91 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.481 ' C ' ' O ' ' A' ' 8' ' ' PRO . 0.6 OUTLIER -28.06 140.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.96 0.409 . . . . 0.0 110.942 179.928 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.474 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 44.3 t -33.27 114.86 0.19 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.073 -179.815 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.616 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.8 OUTLIER -136.56 -142.04 0.17 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.667 179.844 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.876 HD23 HD13 ' A' ' 26' ' ' LEU . 1.5 mp -114.94 140.88 48.65 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.714 0.293 . . . . 0.0 110.368 179.633 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.761 ' HG3' ' HA ' ' A' ' 29' ' ' MET . 3.1 mm-40 -101.2 50.08 0.87 Allowed 'General case' 0 CA--C 1.499 -0.991 0 CA-C-O 121.936 0.874 . . . . 0.0 111.204 -179.41 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.651 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 2.2 tt0 -0.25 120.12 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 113.183 -1.826 . . . . 0.0 111.554 -179.4 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.822 ' OD1' HG11 ' A' ' 76' ' ' VAL . 0.0 OUTLIER -52.55 120.29 17.82 Favored Pre-proline 0 C--N 1.308 -1.204 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.56 -179.815 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -82.34 16.93 1.67 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.479 2.119 . . . . 0.0 112.094 179.592 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.629 ' CE2' ' HG3' ' A' ' 71' ' ' MET . 86.9 t80 -123.73 -54.69 1.74 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.874 -179.921 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.957 ' CD1' HG12 ' A' ' 70' ' ' VAL . 0.3 OUTLIER -75.09 -7.47 53.83 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.318 -179.353 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.625 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -60.0 101.58 0.13 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.651 -179.308 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.593 ' CB ' ' HD2' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -115.41 177.45 1.19 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.265 179.334 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.593 ' HD2' ' CB ' ' A' ' 20' ' ' GLN . 59.5 Cg_endo -71.44 60.38 2.64 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.484 2.122 . . . . 0.0 111.748 179.566 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 149.65 -10.06 0.92 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.499 -179.576 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 1.005 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -146.95 99.4 4.0 Favored Pre-proline 0 CA--C 1.509 -0.625 0 CA-C-O 122.15 0.976 . . . . 0.0 112.021 -179.657 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.708 ' HD2' ' H3 ' ' A' ' 178' ' ' NAG . 98.0 Cg_endo -104.8 79.94 0.02 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.707 0 C-N-CA 125.094 3.863 . . . . 0.0 112.687 -179.054 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.233 ' CG2' HG21 ' A' ' 76' ' ' VAL . 24.3 mm -42.56 -173.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-N 115.509 -0.769 . . . . 0.0 113.019 -179.939 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.005 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -152.97 -159.18 0.97 Allowed 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 -174.822 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.671 ' O ' ' O ' ' A' ' 28' ' ' CYS . 4.0 tm0? 166.04 56.96 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 112.603 -2.09 . . . . 0.0 111.143 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.671 ' O ' ' O ' ' A' ' 27' ' ' GLN . 0.8 OUTLIER 18.37 119.16 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.918 179.876 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.761 ' HA ' ' HG3' ' A' ' 13' ' ' GLN . 5.8 tmm? -73.39 -89.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.899 179.041 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.42 ' O ' ' SD ' ' A' ' 29' ' ' MET . . . 114.22 117.04 3.25 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.501 -179.961 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 178.42 58.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.841 0.353 . . . . 0.0 110.74 179.927 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.653 ' HB2' HG21 ' A' ' 58' ' ' THR . 0.0 OUTLIER -92.66 -171.67 2.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.461 179.829 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.441 ' O ' ' CB ' ' A' ' 34' ' ' SER . 0.1 OUTLIER -174.23 172.64 3.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.906 0.384 . . . . 0.0 111.019 179.996 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.441 ' CB ' ' O ' ' A' ' 33' ' ' PHE . 0.5 OUTLIER 165.07 38.75 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.869 -179.871 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.473 ' C ' ' HD2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER 40.34 96.74 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.005 -179.967 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.78 140.38 58.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.826 179.737 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.602 ' O ' ' CG ' ' A' ' 37' ' ' TYR . 14.7 t80 -142.62 43.02 0.45 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.914 179.952 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 37' ' ' TYR . 18.6 Cg_endo -59.49 -166.78 0.03 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.524 2.15 . . . . 0.0 112.046 179.759 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.43 ' HA ' ' HD3' ' A' ' 40' ' ' PRO . 1.6 t -81.78 152.89 69.86 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.763 179.883 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.434 ' O ' ' C ' ' A' ' 41' ' ' LEU . 5.5 Cg_endo -85.91 52.28 2.98 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.253 2.635 . . . . 0.0 112.165 179.934 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.434 ' C ' ' O ' ' A' ' 40' ' ' PRO . 1.9 mp 35.19 -152.91 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.705 -179.786 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.52 -30.08 8.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.787 179.918 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.402 ' CB ' ' HE3' ' A' ' 45' ' ' LYS . 1.1 m 173.54 -35.11 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.861 179.931 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.2 tptm 66.76 14.5 9.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.63 -179.796 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.501 ' O ' ' HB ' ' A' ' 46' ' ' THR . 9.6 pttp -79.49 105.63 10.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.948 -179.969 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.524 HG23 ' N ' ' A' ' 47' ' ' MET . 0.4 OUTLIER 167.7 169.93 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.59 -179.965 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.524 ' N ' HG23 ' A' ' 46' ' ' THR . 0.0 OUTLIER -51.33 -177.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.726 179.866 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.752 HD12 ' C ' ' A' ' 48' ' ' LEU . 2.9 pp -139.63 165.71 26.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.922 179.972 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.496 ' O ' ' O ' ' A' ' 50' ' ' GLN . 1.2 p -165.82 127.24 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.024 179.699 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.496 ' O ' ' O ' ' A' ' 49' ' ' VAL . 0.3 OUTLIER 49.11 109.64 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.121 179.803 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.404 ' O ' ' HG2' ' A' ' 50' ' ' GLN . 1.7 mttt -55.87 176.13 0.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.258 179.454 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -135.21 153.39 51.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.113 0.483 . . . . 0.0 111.258 -179.897 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -137.61 90.67 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.808 179.597 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -158.49 122.73 4.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.796 -179.986 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.569 ' O ' ' C ' ' A' ' 56' ' ' GLU . 4.6 m -129.3 90.57 3.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.176 -179.771 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.569 ' C ' ' O ' ' A' ' 55' ' ' SER . 0.0 OUTLIER 12.46 104.93 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.849 179.753 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.42 ' O ' ' C ' ' A' ' 58' ' ' THR . 3.2 m -116.66 49.55 1.15 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.003 179.899 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.653 HG21 ' HB2' ' A' ' 32' ' ' CYS . 40.6 p 37.12 -145.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.786 179.871 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.68 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 0.8 OUTLIER -151.36 97.8 2.45 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.057 0.456 . . . . 0.0 112.125 -179.83 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.56 ' C ' HG12 ' A' ' 61' ' ' VAL . 59.2 m -89.36 165.57 14.29 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.39 179.13 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.839 HG22 ' O ' ' A' ' 61' ' ' VAL . 1.3 p 162.68 66.18 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.298 -179.697 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.745 ' HB1' ' O ' ' A' ' 64' ' ' SER . . . 3.03 103.32 0.01 OUTLIER 'General case' 0 CA--C 1.504 -0.793 0 CA-C-O 121.913 0.863 . . . . 0.0 112.559 -179.294 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.81 ' HG3' ' C ' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -48.36 -44.19 34.24 Favored 'General case' 0 CA--C 1.49 -1.327 0 CA-C-N 113.845 -1.525 . . . . 0.0 107.134 177.014 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.749 ' HB3' ' OG1' ' A' ' 80' ' ' THR . 14.2 t -125.54 -178.61 4.3 Favored 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 112.849 -1.978 . . . . 0.0 109.407 179.647 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.625 ' CB ' ' CG ' ' A' ' 77' ' ' GLU . 3.0 p90 -162.27 160.51 26.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.281 0.562 . . . . 0.0 111.703 -179.491 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.943 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 43.9 t-20 -133.92 28.93 3.82 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 122.851 1.31 . . . . 0.0 107.696 177.501 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.55 ' O ' ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -6.14 130.3 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 111.616 -2.538 . . . . 0.0 112.551 -179.856 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 1.015 HG21 ' CG1' ' A' ' 25' ' ' ILE . 3.5 m -139.78 47.8 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.311 179.696 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.624 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 90.1 m -15.89 118.13 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.285 -179.016 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.957 HG12 ' CD1' ' A' ' 18' ' ' PHE . 3.0 m -120.28 -160.46 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.8 0 CA-C-O 121.726 0.774 . . . . 0.0 111.913 -179.867 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.629 ' HG3' ' CE2' ' A' ' 17' ' ' PHE . 29.0 mtp -13.04 131.61 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 113.874 -1.512 . . . . 0.0 112.854 -178.955 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 40.03 24.78 0.06 OUTLIER Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 115.458 -0.792 . . . . 0.0 113.214 179.059 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.536 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 84.91 36.98 10.58 Favored Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.872 179.724 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.725 ' HB2' ' CG2' ' A' ' 70' ' ' VAL . 1.2 m-30 -74.59 122.14 22.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.931 0.395 . . . . 0.0 110.822 179.923 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.18 109.62 22.28 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.784 -179.483 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.233 HG21 ' CG2' ' A' ' 25' ' ' ILE . 34.8 m -98.87 11.76 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.229 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.53 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.705 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER 25.27 42.32 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 -176.968 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.943 ' HB3' ' HB3' ' A' ' 66' ' ' ASN . 51.6 t30 -1.3 67.75 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 113.185 -1.825 . . . . 0.0 109.083 -174.466 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 1.005 ' N ' HD12 ' A' ' 26' ' ' LEU . 39.1 m170 -37.36 121.09 0.82 Allowed 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 112.928 -1.942 . . . . 0.0 113.781 -176.921 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.749 ' OG1' ' HB3' ' A' ' 64' ' ' SER . 2.2 p -104.47 -32.2 9.11 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 113.448 -1.706 . . . . 0.0 109.21 178.203 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.81 ' C ' ' HG3' ' A' ' 63' ' ' LYS . . . -143.15 136.06 27.83 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 177.795 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 1.2 m -124.25 134.74 53.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.902 0.382 . . . . 0.0 110.852 179.973 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.822 ' NE2' HG13 ' A' ' 61' ' ' VAL . 2.0 p80 -119.62 107.39 13.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.384 -179.468 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.68 ' HA ' ' O ' ' A' ' 59' ' ' CYS . 0.5 OUTLIER -108.44 117.55 34.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.309 179.391 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 3.0 p 92.56 175.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.741 -179.638 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 46.73 23.97 0.29 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.929 179.971 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.508 ' O ' ' C ' ' A' ' 88' ' ' TYR . 2.3 p -72.04 105.32 3.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.718 179.95 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.508 ' C ' ' O ' ' A' ' 87' ' ' CYS . 5.1 m-30 -25.18 115.7 0.05 Allowed 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.221 -179.765 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.43 -175.23 4.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.833 -179.599 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.445 ' O ' ' C ' ' A' ' 91' ' ' LYS . 0.2 OUTLIER -163.54 25.52 0.08 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.696 179.797 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.445 ' C ' ' O ' ' A' ' 90' ' ' HIS . 8.0 mmtp 34.22 38.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.74 -179.857 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 90' ' ' HIS . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.189 -0.91 . . . . 0.0 110.923 -179.892 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 1.005 ' H83' ' HB1' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 179' ' ' NAG . . . . . 0.569 ' O7 ' ' H3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 180' ' ' BMA . . . . . 0.448 ' H5 ' ' H5 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 181' ' ' MAN . . . . . 0.526 ' O2 ' ' O7 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 182' ' ' MAN . . . . . 0.448 ' H5 ' ' H5 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 183' ' ' NAG . . . . . 0.758 ' H4 ' ' O2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 184' ' ' NAG . . . . . 0.755 ' C1 ' ' O7 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 186' ' ' GAL . . . . . 0.758 ' O2 ' ' H4 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.423 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.715 0.293 . . . . 0.0 110.876 . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 1' ' ' ALA . 2.6 Cg_exo -75.28 108.55 2.73 Favored 'Trans proline' 0 N--CA 1.463 -0.277 0 C-N-CA 122.943 2.429 . . . . 0.0 112.417 -179.708 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.507 ' O ' ' N ' ' A' ' 5' ' ' GLN . 0.2 OUTLIER -146.83 26.89 1.1 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.978 179.869 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.482 ' O ' HG23 ' A' ' 4' ' ' VAL . 7.6 m 33.45 33.5 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.083 179.927 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.507 ' N ' ' O ' ' A' ' 3' ' ' ASP . 0.1 OUTLIER -94.2 -166.49 1.5 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.98 179.982 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.427 ' O ' ' C ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -58.81 109.92 0.91 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.925 -179.981 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.436 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 35.4 t -35.44 123.22 0.63 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.023 179.982 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.517 ' O ' ' CZ ' ' A' ' 33' ' ' PHE . 42.9 Cg_exo -57.13 -155.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 122.963 2.442 . . . . 0.0 112.494 -179.92 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.493 ' O ' ' C ' ' A' ' 10' ' ' CYS . 3.0 tt0 -124.1 139.61 53.77 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.144 -179.881 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.547 ' HA ' ' C ' ' A' ' 30' ' ' GLY . 49.0 t -27.32 120.41 0.1 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.389 179.818 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.713 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 9.2 t -170.14 -176.05 2.15 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-O 121.185 0.517 . . . . 0.0 110.821 179.582 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.929 HD23 HD13 ' A' ' 26' ' ' LEU . 2.4 mp -95.41 138.12 33.54 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.668 179.354 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.73 ' O ' ' O ' ' A' ' 14' ' ' GLU . 3.7 pt20 -123.0 69.23 0.99 Allowed 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 122.134 0.969 . . . . 0.0 111.749 178.831 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.73 ' O ' ' O ' ' A' ' 13' ' ' GLN . 28.0 tt0 14.78 123.57 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 112.704 -2.044 . . . . 0.0 112.255 179.998 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.934 HD22 HG11 ' A' ' 76' ' ' VAL . 33.2 t-20 -48.05 107.26 0.71 Allowed Pre-proline 0 C--N 1.306 -1.31 0 CA-C-N 113.527 -1.67 . . . . 0.0 112.072 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.732 ' HD2' ' CE1' ' A' ' 17' ' ' PHE . 72.8 Cg_endo -73.81 16.37 0.52 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.407 2.072 . . . . 0.0 112.958 179.7 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.732 ' CE1' ' HD2' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -126.24 -57.54 1.39 Allowed 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 121.787 0.804 . . . . 0.0 110.205 178.832 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.966 ' CD2' HG13 ' A' ' 70' ' ' VAL . 2.7 t80 -71.92 -19.19 61.96 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.219 -179.088 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.597 ' HB3' ' O ' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -48.76 87.61 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.546 -179.983 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.559 ' O ' ' N ' ' A' ' 22' ' ' GLY . 10.2 mm-40 -112.3 166.3 11.25 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.941 -179.65 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -61.85 60.83 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.752 2.301 . . . . 0.0 111.329 179.337 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.559 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 155.45 -14.24 0.45 Allowed Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.635 -179.611 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.452 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -142.97 108.87 5.44 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-O 121.784 0.802 . . . . 0.0 111.678 -179.492 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.634 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.8 Cg_endo -103.97 60.39 0.02 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.428 0 C-N-CA 124.613 3.542 . . . . 0.0 113.199 -178.556 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.31 ' CG2' HG21 ' A' ' 76' ' ' VAL . 31.6 mm -43.48 -174.07 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 CA-C-N 115.327 -0.852 . . . . 0.0 112.566 179.194 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.941 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -145.23 -168.27 2.9 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -175.011 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 172.4 96.01 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 111.482 -2.599 . . . . 0.0 109.99 179.2 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.713 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -40.51 112.49 0.29 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.83 -178.924 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.549 ' HB2' ' HG2' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -121.26 -19.01 7.21 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.463 -0.495 . . . . 0.0 111.946 -179.874 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.547 ' C ' ' HA ' ' A' ' 10' ' ' CYS . . . -44.59 179.99 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.342 -0.932 . . . . 0.0 112.377 179.978 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.502 ' O ' ' SG ' ' A' ' 31' ' ' CYS . 15.4 p -144.75 104.05 3.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.953 0.406 . . . . 0.0 110.756 179.619 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.427 ' HB3' ' HB2' ' A' ' 10' ' ' CYS . 0.5 OUTLIER -79.84 135.27 36.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.135 -179.62 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.517 ' CZ ' ' O ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -135.04 130.33 35.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.729 179.886 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.0 p -42.89 153.05 0.09 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.132 -179.939 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.515 ' O ' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -95.9 166.37 11.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.252 -179.84 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.515 ' HB3' ' O ' ' A' ' 35' ' ' ARG . . . 73.39 138.66 0.06 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.453 179.821 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -63.25 156.21 70.26 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.799 179.904 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.702 ' O ' HG23 ' A' ' 39' ' ' THR . 63.1 Cg_endo -73.96 114.29 4.0 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.608 2.205 . . . . 0.0 112.361 -179.964 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.702 HG23 ' O ' ' A' ' 38' ' ' PRO . 1.1 p -167.43 164.35 9.38 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.982 -179.941 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -80.29 -166.15 0.39 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.152 2.568 . . . . 0.0 112.091 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.504 ' HG ' ' N ' ' A' ' 42' ' ' ARG . 0.2 OUTLIER 177.72 -35.83 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.69 179.888 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.656 ' O ' ' CB ' ' A' ' 43' ' ' SER . 0.0 OUTLIER 82.01 79.31 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.062 179.795 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.656 ' CB ' ' O ' ' A' ' 42' ' ' ARG . 8.9 t 142.17 5.53 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.049 179.73 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.47 ' C ' ' O ' ' A' ' 43' ' ' SER . 2.1 tttp -31.1 130.69 0.11 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.821 0.343 . . . . 0.0 111.169 -179.998 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.521 ' O ' ' C ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -54.62 114.88 1.86 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.494 179.767 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.521 ' C ' ' O ' ' A' ' 45' ' ' LYS . 5.4 t -26.25 91.44 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.991 -179.804 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.577 ' C ' HD13 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -73.85 150.45 40.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.159 -179.58 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.893 HD13 ' N ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -145.53 159.08 43.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.884 -179.918 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.588 HG11 ' HB3' ' A' ' 55' ' ' SER . 0.0 OUTLIER -127.58 172.27 14.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.062 -179.945 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -42.55 138.77 1.73 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.529 179.943 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.598 ' HE3' ' CD2' ' A' ' 88' ' ' TYR . 32.9 mttp 46.18 -139.64 0.49 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.27 -179.811 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -132.67 19.55 4.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.053 0.454 . . . . 0.0 110.416 179.359 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.408 ' O ' ' O ' ' A' ' 54' ' ' THR . 33.5 m -149.24 162.25 4.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.889 179.906 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.453 HG22 ' O ' ' A' ' 54' ' ' THR . 2.6 m 44.55 96.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.953 -179.851 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.588 ' HB3' HG11 ' A' ' 49' ' ' VAL . 1.7 m -93.32 152.8 18.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.977 -179.984 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.429 ' O ' ' CB ' ' A' ' 57' ' ' SER . 13.1 mt-10 -143.28 -79.34 0.21 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.876 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.429 ' CB ' ' O ' ' A' ' 56' ' ' GLU . 4.1 p 164.75 -178.65 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.613 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.586 HG22 ' HA ' ' A' ' 85' ' ' SER . 1.3 p -42.47 155.47 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.774 -179.914 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.493 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 18.8 p -148.8 129.51 14.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.136 0.493 . . . . 0.0 111.539 -179.737 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.864 ' O ' HG23 ' A' ' 61' ' ' VAL . 71.0 m -85.86 -169.87 2.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.145 179.77 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.864 HG23 ' O ' ' A' ' 60' ' ' CYS . 2.6 t 142.59 79.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.377 179.822 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.702 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . -6.11 105.75 0.01 OUTLIER 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 122.065 0.936 . . . . 0.0 112.415 -179.916 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.792 ' HG3' ' CB ' ' A' ' 81' ' ' ALA . 0.1 OUTLIER -50.51 -43.53 55.77 Favored 'General case' 0 CA--C 1.495 -1.142 0 CA-C-N 113.733 -1.576 . . . . 0.0 108.397 177.802 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.607 ' CB ' ' OG1' ' A' ' 80' ' ' THR . 43.7 m -133.11 135.51 45.29 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 113.637 -1.619 . . . . 0.0 109.48 179.906 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.817 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -125.71 163.02 23.73 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.604 0.716 . . . . 0.0 112.436 -177.88 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.794 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -132.12 30.18 4.27 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 122.704 1.24 . . . . 0.0 107.9 177.388 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.54 ' CG ' ' HA ' ' A' ' 77' ' ' GLU . 0.2 OUTLIER -8.69 128.15 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 112.075 -2.329 . . . . 0.0 112.148 -179.786 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 1.047 HG21 HG13 ' A' ' 25' ' ' ILE . 4.6 m -134.84 49.52 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.454 179.915 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.661 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 55.2 m -23.2 118.62 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.196 -179.173 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.966 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -111.65 -167.39 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.726 0.774 . . . . 0.0 112.366 -179.603 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.521 ' C ' ' O ' ' A' ' 70' ' ' VAL . 1.2 mmm 16.62 -131.7 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.14 -1.391 . . . . 0.0 112.191 -179.937 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.81 -4.06 1.97 Allowed Glycine 0 N--CA 1.445 -0.74 0 CA-C-N 115.447 -0.797 . . . . 0.0 113.287 -179.63 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.587 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 130.22 28.68 0.7 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.137 -179.766 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.661 ' O ' ' HA ' ' A' ' 69' ' ' THR . 23.0 m-85 -66.13 120.42 13.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.831 0.348 . . . . 0.0 110.943 -179.644 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.506 ' HB3' ' HD3' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -99.79 115.56 29.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.804 -179.391 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 1.31 HG21 ' CG2' ' A' ' 25' ' ' ILE . 19.0 m -104.16 11.14 8.51 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.273 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.989 178.967 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.817 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 27.39 41.5 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 -177.172 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.915 ' HB2' HG13 ' A' ' 68' ' ' VAL . 50.3 t30 -1.23 68.09 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 113.729 -1.578 . . . . 0.0 109.149 -174.566 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.941 ' N ' HD12 ' A' ' 26' ' ' LEU . 41.8 m170 -38.59 120.19 0.91 Allowed 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 112.57 -2.105 . . . . 0.0 113.905 -176.743 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.607 ' OG1' ' CB ' ' A' ' 64' ' ' SER . 2.2 p -105.14 -34.88 7.79 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 113.503 -1.681 . . . . 0.0 109.557 178.542 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.792 ' CB ' ' HG3' ' A' ' 63' ' ' LYS . . . -140.89 140.04 34.48 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 177.625 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.585 ' SG ' HD11 ' A' ' 12' ' ' LEU . 0.8 OUTLIER -128.09 133.71 49.06 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.59 -0.444 . . . . 0.0 111.818 -179.071 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.555 ' HB3' ' CD ' ' A' ' 63' ' ' LYS . 8.0 p80 -114.95 -175.39 2.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.673 179.713 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 59' ' ' CYS . 7.8 t -172.35 104.39 0.17 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.446 179.869 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.586 ' HA ' HG22 ' A' ' 58' ' ' THR . 2.7 p 162.32 164.01 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.93 -179.757 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.562 ' C ' ' O ' ' A' ' 85' ' ' SER . 54.6 m -15.65 113.22 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.513 -179.861 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 36.3 m -80.84 -173.21 4.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.365 -179.706 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.598 ' CD2' ' HE3' ' A' ' 51' ' ' LYS . 0.0 OUTLIER 62.96 175.64 0.15 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.009 179.876 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.478 ' O ' ' HB3' ' A' ' 90' ' ' HIS . 11.4 t80 58.69 126.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.862 179.916 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.576 ' O ' ' CG ' ' A' ' 90' ' ' HIS . 28.7 t60 66.5 59.69 0.62 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.011 0.434 . . . . 0.0 110.402 -179.673 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.9 -63.54 1.15 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.106 -179.717 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.913 -179.879 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 178' ' ' NAG . . . . . 1.07 ' H82' HD11 ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 180' ' ' BMA . . . . . 0.456 ' O4 ' ' H2 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 181' ' ' MAN . . . . . 0.487 ' O3 ' ' H5 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 183' ' ' NAG . . . . . 0.487 ' H5 ' ' O3 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.754 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 7.1 t . . . . . 0 CA--C 1.518 -0.252 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.054 HD23 HD13 ' A' ' 26' ' ' LEU . 5.8 mp -111.25 134.72 52.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.753 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.752 ' HG3' ' HA ' ' A' ' 29' ' ' MET . 0.5 OUTLIER -98.26 51.29 1.02 Allowed 'General case' 0 CA--C 1.502 -0.868 0 CA-C-O 121.389 0.614 . . . . 0.0 111.766 -179.385 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.677 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 38.8 tt0 0.33 117.85 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 114.118 -1.401 . . . . 0.0 111.187 -179.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.978 ' ND2' HG11 ' A' ' 76' ' ' VAL . 6.7 t-20 -46.87 115.14 3.17 Favored Pre-proline 0 C--N 1.305 -1.367 0 CA-C-N 114.186 -1.37 . . . . 0.0 112.188 -179.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -80.35 16.44 1.54 Allowed 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.822 2.348 . . . . 0.0 111.262 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.41 ' CD1' ' C ' ' A' ' 17' ' ' PHE . 9.1 t80 -125.04 -55.06 1.6 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.886 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.962 ' CD2' HG13 ' A' ' 70' ' ' VAL . 0.4 OUTLIER -73.71 -16.17 61.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.588 179.966 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.603 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 17.1 p -52.98 79.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.524 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.598 ' N ' ' O ' ' A' ' 18' ' ' PHE . 3.3 pt20 -104.03 167.61 9.79 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.145 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -61.17 63.08 0.1 OUTLIER 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.682 2.255 . . . . 0.0 111.683 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.553 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 147.91 -8.65 1.12 Allowed Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.391 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.537 ' HB3' ' HG2' ' A' ' 20' ' ' GLN . . . -147.68 102.95 3.68 Favored Pre-proline 0 CA--C 1.513 -0.442 0 CA-C-O 122.071 0.939 . . . . 0.0 111.996 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.603 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 90.7 Cg_endo -104.14 65.32 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.51 0 C-N-CA 124.923 3.749 . . . . 0.0 112.795 -178.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.29 ' CG2' HG21 ' A' ' 76' ' ' VAL . 34.3 mm -42.23 -177.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.083 0 CA-C-N 115.198 -0.91 . . . . 0.0 113.444 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.054 HD13 HD23 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -148.23 -155.77 0.66 Allowed 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -174.719 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.523 ' O ' ' CG ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER 159.93 67.17 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 113.143 -1.844 . . . . 0.0 111.478 179.569 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.754 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.1 OUTLIER 4.8 118.33 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 114.992 -1.004 . . . . 0.0 113.425 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.752 ' HA ' ' HG3' ' A' ' 13' ' ' GLN . 3.9 ttt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.481 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.605 ' O ' ' C ' ' A' ' 62' ' ' ALA . 23.8 t . . . . . 0 N--CA 1.456 -0.159 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.717 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 17.96 95.13 0.0 OUTLIER 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.889 -178.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.899 ' N ' ' O ' ' A' ' 81' ' ' ALA . 21.7 tttm -50.3 -32.84 18.04 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-O 121.648 0.737 . . . . 0.0 109.198 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.642 ' O ' ' N ' ' A' ' 80' ' ' THR . 12.7 m -147.37 105.14 3.71 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.039 179.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.817 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 2.9 p90 -91.04 164.63 13.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.486 0.66 . . . . 0.0 112.072 -179.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.707 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 3.5 t-20 -135.71 28.95 3.24 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 122.927 1.346 . . . . 0.0 107.823 177.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.516 ' CG ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -9.86 131.95 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 111.637 -2.529 . . . . 0.0 112.559 -179.48 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 1.058 HG21 ' CG1' ' A' ' 25' ' ' ILE . 14.0 m -139.36 52.24 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.323 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.686 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 50.7 m -24.62 118.3 0.05 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.564 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.962 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -115.92 -168.93 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.499 0.666 . . . . 0.0 112.316 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.568 ' SD ' ' CD2' ' A' ' 74' ' ' PHE . 1.1 mtp 30.44 -137.56 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.711 -1.131 . . . . 0.0 111.034 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -71.55 14.78 1.76 Allowed Glycine 0 N--CA 1.443 -0.833 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.624 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.552 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 123.92 36.78 0.61 Allowed Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.959 -0.639 . . . . 0.0 111.881 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.686 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.7 m-85 -75.16 118.3 17.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.961 0.41 . . . . 0.0 111.096 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.471 ' HB3' ' HD3' ' A' ' 67' ' ' ARG . 0.1 OUTLIER -98.71 124.12 43.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.478 0.656 . . . . 0.0 111.393 -179.526 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.29 HG21 ' CG2' ' A' ' 25' ' ' ILE . 27.1 m -117.69 11.67 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.308 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.201 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.817 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.4 OUTLIER 25.81 40.54 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 -177.124 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.73 ' N ' ' O ' ' A' ' 76' ' ' VAL . 33.6 t30 -2.97 69.53 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 113.528 -1.669 . . . . 0.0 109.26 -174.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.996 ' N ' HD12 ' A' ' 26' ' ' LEU . 40.5 m170 -39.54 120.02 1.03 Allowed 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 113.068 -1.878 . . . . 0.0 113.266 -177.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.642 ' N ' ' O ' ' A' ' 64' ' ' SER . 0.6 OUTLIER -112.52 -5.65 14.02 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 113.425 -1.716 . . . . 0.0 110.325 179.606 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.899 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -171.38 83.9 0.08 Allowed 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.278 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.57 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 1.2 m -80.52 127.99 33.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.73 0.3 . . . . 0.0 110.943 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.412 ' HD2' ' N ' ' A' ' 63' ' ' LYS . 5.1 p80 . . . . . 0 C--N 1.333 -0.127 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.322 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.706 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 10.0 t . . . . . 0 CA--C 1.513 -0.449 0 CA-C-O 120.807 0.337 . . . . 0.0 110.495 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.912 HD23 HD13 ' A' ' 26' ' ' LEU . 6.5 mp -81.22 135.37 35.74 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.0 -179.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.652 ' O ' ' O ' ' A' ' 14' ' ' GLU . 54.6 mt-30 -118.33 57.53 0.85 Allowed 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.365 179.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.652 ' O ' ' O ' ' A' ' 13' ' ' GLN . 6.1 tt0 7.69 119.87 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.813 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.931 ' ND2' HG11 ' A' ' 76' ' ' VAL . 3.5 t-20 -39.22 128.03 1.3 Allowed Pre-proline 0 C--N 1.309 -1.167 0 CA-C-N 114.337 -1.302 . . . . 0.0 111.837 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.486 ' HD2' ' OD1' ' A' ' 15' ' ' ASN . 94.2 Cg_endo -85.22 31.95 0.48 Allowed 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.65 2.233 . . . . 0.0 111.167 178.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.521 ' CE2' ' HG3' ' A' ' 71' ' ' MET . 22.4 t80 -148.41 -55.75 0.21 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.634 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.869 ' CE2' HG13 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -70.76 -26.0 63.16 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.825 -1.079 . . . . 0.0 110.834 -179.51 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.675 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 35.9 t -50.92 81.09 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.944 -179.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.584 ' N ' ' O ' ' A' ' 18' ' ' PHE . 3.9 mm-40 -122.55 159.01 54.75 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.068 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -51.02 77.52 0.02 OUTLIER 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.748 2.299 . . . . 0.0 111.876 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 138.61 -18.63 3.21 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.601 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.504 ' O ' ' O ' ' A' ' 18' ' ' PHE . . . -147.11 102.76 3.82 Favored Pre-proline 0 CA--C 1.513 -0.475 0 CA-C-O 121.871 0.843 . . . . 0.0 111.782 -179.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.675 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 93.5 Cg_endo -105.89 64.49 0.02 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.564 0 C-N-CA 124.671 3.58 . . . . 0.0 113.603 -178.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.233 ' CG2' HG21 ' A' ' 76' ' ' VAL . 24.5 mm -43.4 -174.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.051 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.691 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.143 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -151.37 -161.67 1.38 Allowed 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 114.49 1.292 . . . . 0.0 114.49 -175.418 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.493 ' CB ' ' O ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER 159.72 83.51 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 112.809 -1.996 . . . . 0.0 110.9 179.104 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.706 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.0 OUTLIER -27.57 110.5 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.004 -179.405 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.589 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.7 mmt . . . . . 0 C--N 1.33 -0.246 0 CA-C-O 120.902 0.382 . . . . 0.0 111.161 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.575 HG13 ' O ' ' A' ' 61' ' ' VAL . 9.6 p . . . . . 0 N--CA 1.463 0.18 0 CA-C-O 120.697 0.284 . . . . 0.0 110.604 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.588 ' HA ' ' HA ' ' A' ' 82' ' ' CYS . . . 10.28 110.02 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.511 -179.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.884 ' N ' ' O ' ' A' ' 81' ' ' ALA . 8.2 ttmt -57.01 -42.96 81.3 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.611 0.72 . . . . 0.0 109.088 178.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.523 ' O ' ' N ' ' A' ' 80' ' ' THR . 16.9 m -141.03 128.75 21.57 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.523 -1.217 . . . . 0.0 109.095 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.748 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 4.8 p90 -114.73 157.52 23.07 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -178.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.945 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -125.3 27.97 6.45 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 122.615 1.198 . . . . 0.0 108.219 176.645 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.7 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 4.2 ptp180 -8.35 103.72 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 112.36 -2.2 . . . . 0.0 111.966 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 1.018 HG21 HG13 ' A' ' 25' ' ' ILE . 3.4 m -104.02 45.93 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.393 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.675 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 28.5 m -16.33 119.05 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.63 -178.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.869 HG13 ' CE2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -113.49 -162.8 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.691 179.94 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.521 ' HG3' ' CE2' ' A' ' 17' ' ' PHE . 6.0 mtp -29.13 151.58 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.208 -1.36 . . . . 0.0 111.907 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 43.7 23.87 0.39 Allowed Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.645 -0.788 . . . . 0.0 111.966 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.463 ' C ' HG23 ' A' ' 69' ' ' THR . . . 73.77 28.84 64.25 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.163 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.708 ' CB ' HG23 ' A' ' 70' ' ' VAL . 20.3 m-85 -43.81 170.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.65 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 22.3 mtmt -153.72 93.26 1.65 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.859 0.361 . . . . 0.0 111.318 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.233 HG21 ' CG2' ' A' ' 25' ' ' ILE . 18.6 m -93.0 15.73 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.489 -1.391 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.764 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.748 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 23.42 43.72 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 -177.691 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.945 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 12.9 t-20 1.55 75.52 0.0 OUTLIER 'General case' 0 CA--C 1.499 -1.005 0 CA-C-N 114.519 -1.219 . . . . 0.0 108.043 -175.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 1.143 ' N ' HD12 ' A' ' 26' ' ' LEU . 33.6 m170 -49.19 99.58 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.419 0 CA-C-O 122.61 1.195 . . . . 0.0 111.669 -176.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.711 HG23 ' O ' ' A' ' 78' ' ' ASN . 2.8 p -92.07 -3.5 55.66 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.55 -1.659 . . . . 0.0 109.71 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.884 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -174.33 126.75 0.34 Allowed 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.5 OUTLIER -121.47 127.91 51.56 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.987 0.422 . . . . 0.0 111.281 -179.21 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.415 ' CD2' ' O ' ' A' ' 83' ' ' HIS . 0.3 OUTLIER . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.788 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.709 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 4.8 t . . . . . 0 CA--C 1.515 -0.387 0 CA-C-O 121.159 0.504 . . . . 0.0 111.021 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.864 HD23 HD13 ' A' ' 26' ' ' LEU . 8.2 mp -75.28 126.34 30.81 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.925 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.586 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.9 mt-30 -104.16 52.81 0.75 Allowed 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.948 179.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.645 ' HG3' ' HB2' ' A' ' 24' ' ' PRO . 2.1 tt0 -1.16 121.87 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.159 -1.837 . . . . 0.0 111.401 -178.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.735 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.4 OUTLIER -58.68 102.06 0.28 Allowed Pre-proline 0 C--N 1.307 -1.247 0 CA-C-N 114.348 -1.296 . . . . 0.0 112.565 -179.101 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.522 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 2.8 Cg_exo -73.45 2.37 5.8 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.267 1.978 . . . . 0.0 109.084 177.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.527 ' CE1' ' SD ' ' A' ' 71' ' ' MET . 2.1 t80 -93.3 -60.69 1.73 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 113.557 -1.656 . . . . 0.0 110.287 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.866 ' CD1' HG21 ' A' ' 70' ' ' VAL . 12.6 m-85 -81.35 -5.79 58.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.044 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.512 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -52.81 89.15 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.51 179.72 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.553 ' CB ' ' CD ' ' A' ' 21' ' ' PRO . 5.3 pt20 -96.55 -176.38 0.53 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.818 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.553 ' CD ' ' CB ' ' A' ' 20' ' ' GLN . 2.9 Cg_endo -73.86 60.63 4.51 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.522 2.148 . . . . 0.0 111.402 179.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 143.12 3.35 0.9 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.661 -0.78 . . . . 0.0 113.263 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.471 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -154.56 105.82 2.36 Favored Pre-proline 0 CA--C 1.514 -0.405 0 CA-C-O 121.894 0.854 . . . . 0.0 111.808 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.661 ' O ' ' O ' ' A' ' 25' ' ' ILE . 66.6 Cg_endo -103.4 73.08 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.392 0 C-N-CA 124.77 3.647 . . . . 0.0 113.004 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.162 ' CG2' HG21 ' A' ' 76' ' ' VAL . 6.7 mm -38.52 -177.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.885 ' N ' HG22 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -151.21 -163.66 1.82 Allowed 'General case' 0 CA--C 1.499 -1.013 0 CA-C-O 122.851 1.31 . . . . 0.0 114.262 -175.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.558 ' O ' ' CG ' ' A' ' 27' ' ' GLN . 0.3 OUTLIER 166.27 66.49 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 112.363 -2.198 . . . . 0.0 110.836 179.331 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.709 ' HA ' ' O ' ' A' ' 11' ' ' THR . 3.9 t -24.73 109.26 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.223 -179.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.52 ' HG2' ' OE1' ' A' ' 13' ' ' GLN . 3.4 ttm . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.078 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.661 ' O ' HG12 ' A' ' 61' ' ' VAL . 40.1 t . . . . . 0 N--CA 1.461 0.078 0 CA-C-O 120.763 0.316 . . . . 0.0 110.979 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.692 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 16.83 112.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.634 ' N ' ' O ' ' A' ' 81' ' ' ALA . 20.2 ttmt -54.16 -33.61 58.41 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.652 ' O ' ' HB1' ' A' ' 62' ' ' ALA . 1.8 m -137.27 -175.32 4.02 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.964 178.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.69 ' HB3' ' HB3' ' A' ' 77' ' ' GLU . 1.0 OUTLIER -164.6 162.06 21.34 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.288 0.566 . . . . 0.0 111.588 -179.77 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.674 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -132.54 27.66 4.36 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.194 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.6 ' HG3' ' HA ' ' A' ' 77' ' ' GLU . 2.4 ttm105 -8.05 121.4 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 112.284 -2.235 . . . . 0.0 111.311 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 1.069 HG13 ' HB2' ' A' ' 78' ' ' ASN . 4.3 m -123.72 43.62 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.803 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.653 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 54.5 m -17.82 118.35 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.764 -178.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.866 HG21 ' CD1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -122.25 -169.79 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.485 -179.054 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.632 ' HG3' ' CG ' ' A' ' 74' ' ' PHE . 0.1 OUTLIER 41.54 -140.09 0.12 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.368 -179.59 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -70.63 0.34 27.68 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.811 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.431 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 136.11 40.94 0.13 Allowed Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.525 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.675 ' C ' ' HG2' ' A' ' 75' ' ' LYS . 2.4 m-85 -69.41 -179.33 1.62 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.675 ' HG2' ' C ' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -157.45 97.58 1.62 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.984 0.365 . . . . 0.0 111.984 -179.466 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.162 HG21 ' CG2' ' A' ' 25' ' ' ILE . 16.3 m -91.62 11.93 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.42 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.755 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 29.22 39.56 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 105.083 -2.192 . . . . 0.0 105.083 -176.601 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 1.069 ' HB2' HG13 ' A' ' 68' ' ' VAL . 32.7 t30 -0.14 65.45 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 112.816 -1.993 . . . . 0.0 108.378 -174.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.881 ' O ' HD13 ' A' ' 26' ' ' LEU . 37.8 m170 -34.46 123.58 0.52 Allowed 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 112.703 -2.044 . . . . 0.0 113.43 -176.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.492 ' OG1' ' HB3' ' A' ' 64' ' ' SER . 6.5 p -110.78 -15.14 13.88 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 113.471 -1.695 . . . . 0.0 110.426 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.634 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -161.87 147.65 13.47 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.888 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.5 OUTLIER -127.27 154.55 44.75 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.904 0.383 . . . . 0.0 111.227 -179.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.438 ' CD2' ' O ' ' A' ' 83' ' ' HIS . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.943 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.689 ' O ' ' N ' ' A' ' 29' ' ' MET . 3.3 t . . . . . 0 CA--C 1.512 -0.489 0 CA-C-O 121.101 0.477 . . . . 0.0 110.37 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.853 HD23 HD13 ' A' ' 26' ' ' LEU . 7.8 mp -75.74 133.66 40.68 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.274 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.713 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.7 mt-30 -120.75 65.12 0.85 Allowed 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 121.636 0.731 . . . . 0.0 110.977 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.713 ' O ' ' O ' ' A' ' 13' ' ' GLN . 18.2 tt0 2.91 127.22 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 113.566 -1.652 . . . . 0.0 111.903 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.931 ' ND2' HG11 ' A' ' 76' ' ' VAL . 1.3 t30 -56.19 108.82 1.32 Allowed Pre-proline 0 C--N 1.307 -1.28 0 CA-C-N 113.858 -1.519 . . . . 0.0 113.339 -178.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.755 ' HD2' ' CE1' ' A' ' 17' ' ' PHE . 9.9 Cg_exo -69.95 4.95 1.97 Allowed 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.508 2.139 . . . . 0.0 112.042 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.755 ' CE1' ' HD2' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -114.12 -56.16 2.42 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.394 178.674 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 1.187 ' CD2' HG13 ' A' ' 70' ' ' VAL . 0.3 OUTLIER -78.97 -5.58 54.18 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.888 -178.751 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.468 ' CB ' ' O ' ' A' ' 15' ' ' ASN . 2.2 t -64.91 95.28 0.15 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.746 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.575 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.1 OUTLIER -135.84 144.74 49.92 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.857 -179.649 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.563 ' CD ' ' HG3' ' A' ' 20' ' ' GLN . 1.3 Cg_endo -45.1 82.91 0.01 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.7 2.267 . . . . 0.0 111.343 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.575 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 138.35 -15.87 3.41 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.73 -179.088 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.444 ' O ' ' O ' ' A' ' 18' ' ' PHE . . . -153.95 100.28 2.53 Favored Pre-proline 0 CA--C 1.51 -0.587 0 CA-C-O 121.958 0.885 . . . . 0.0 111.094 179.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.662 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.1 Cg_endo -103.26 60.33 0.02 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.588 0 C-N-CA 124.643 3.562 . . . . 0.0 112.78 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.226 ' CG2' HG21 ' A' ' 76' ' ' VAL . 23.1 mm -40.25 -176.69 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.141 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.876 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.994 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -148.87 -160.16 1.13 Allowed 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -175.105 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.466 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER 161.8 98.17 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 112.376 -2.193 . . . . 0.0 109.723 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.649 ' SG ' HD12 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -48.29 103.65 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.492 -0.777 . . . . 0.0 111.711 -178.531 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.689 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.47 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.624 ' O ' ' C ' ' A' ' 62' ' ' ALA . 47.8 t . . . . . 0 N--CA 1.456 -0.131 0 CA-C-O 120.559 0.219 . . . . 0.0 110.713 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.624 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 0.3 103.36 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.696 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.791 ' N ' ' O ' ' A' ' 81' ' ' ALA . 1.6 ttmm -54.84 -38.74 67.81 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.545 ' O ' ' N ' ' A' ' 80' ' ' THR . 15.5 m -140.94 117.0 10.52 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.779 -1.101 . . . . 0.0 109.717 178.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.752 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 2.8 p90 -107.57 161.99 14.36 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.283 -178.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.82 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 1.0 OUTLIER -129.69 28.13 5.16 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 122.357 1.075 . . . . 0.0 108.173 177.11 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.744 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -11.85 115.81 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 112.565 -2.107 . . . . 0.0 111.734 -179.899 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 1.044 HG21 HG13 ' A' ' 25' ' ' ILE . 3.8 m -120.14 48.12 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 114.867 -1.06 . . . . 0.0 110.737 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.637 ' C ' ' O ' ' A' ' 68' ' ' VAL . 5.8 m -14.05 118.84 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.079 -179.062 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 1.187 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -107.52 -162.42 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.799 0.809 . . . . 0.0 111.729 -179.8 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.539 ' O ' ' CD1' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -32.66 151.45 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.929 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 48.01 19.23 0.95 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.15 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.58 ' C ' HG23 ' A' ' 69' ' ' THR . . . 70.82 30.26 68.41 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.303 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.587 ' O ' ' HA ' ' A' ' 69' ' ' THR . 5.8 m-30 -51.67 -174.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.803 0.335 . . . . 0.0 111.007 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -158.97 121.05 3.49 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.274 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.226 HG21 ' CG2' ' A' ' 25' ' ' ILE . 19.6 m -118.18 12.08 7.11 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.494 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.437 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.752 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 28.26 39.71 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 -177.05 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.919 ' HB2' HG13 ' A' ' 68' ' ' VAL . 49.2 t30 -0.8 68.49 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.899 0 CA-C-N 113.531 -1.668 . . . . 0.0 108.55 -174.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.994 ' N ' HD12 ' A' ' 26' ' ' LEU . 39.4 m170 -39.48 118.01 0.78 Allowed 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 113.198 -1.819 . . . . 0.0 114.1 -176.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.545 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.0 OUTLIER -109.12 -17.01 13.98 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 113.379 -1.737 . . . . 0.0 109.487 178.792 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.791 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -162.88 136.93 6.19 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.263 -0.88 . . . . 0.0 108.942 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -125.9 140.98 52.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.706 0.289 . . . . 0.0 110.636 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.331 -0.216 0 CA-C-O 120.98 0.419 . . . . 0.0 111.502 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.678 ' O ' HD12 ' A' ' 12' ' ' LEU . 1.0 OUTLIER . . . . . 0 N--CA 1.456 -0.139 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.846 HD23 HD13 ' A' ' 26' ' ' LEU . 6.1 mp -122.27 138.19 54.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.154 0.502 . . . . 0.0 111.093 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.63 ' O ' ' C ' ' A' ' 14' ' ' GLU . 1.6 mt-30 -96.15 44.97 1.07 Allowed 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.197 -179.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.66 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 21.8 tt0 -2.53 116.63 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 114.143 -1.389 . . . . 0.0 110.66 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.746 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.9 OUTLIER -56.03 103.1 0.34 Allowed Pre-proline 0 C--N 1.304 -1.4 0 CA-C-N 114.223 -1.353 . . . . 0.0 112.367 -178.8 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.553 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 72.6 Cg_endo -75.37 10.27 1.89 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.247 1.965 . . . . 0.0 109.887 177.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.576 ' CZ ' ' SD ' ' A' ' 71' ' ' MET . 0.8 OUTLIER -106.06 -59.55 1.76 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.212 -1.358 . . . . 0.0 110.879 -179.478 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.768 ' HD2' HG21 ' A' ' 25' ' ' ILE . 8.8 m-85 -80.34 -1.71 42.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.822 -179.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.464 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 27.4 t -48.94 93.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.841 0.353 . . . . 0.0 110.179 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.543 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.1 OUTLIER -91.43 168.38 13.56 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.921 -179.566 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.417 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 27.2 Cg_exo -62.55 59.69 0.14 Allowed 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.708 2.272 . . . . 0.0 111.462 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.543 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 138.62 5.21 1.51 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.898 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.419 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -150.98 101.69 3.02 Favored Pre-proline 0 CA--C 1.511 -0.543 0 CA-C-O 122.082 0.944 . . . . 0.0 111.938 -179.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.587 ' O ' ' O ' ' A' ' 25' ' ' ILE . 18.6 Cg_endo -96.17 81.24 0.1 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.464 0 C-N-CA 124.504 3.469 . . . . 0.0 112.708 -179.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.244 ' CG2' HG21 ' A' ' 76' ' ' VAL . 12.6 mm -42.01 -175.59 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.95 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -153.72 -160.37 1.1 Allowed 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 -175.229 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.539 ' O ' ' O ' ' A' ' 28' ' ' CYS . 1.8 tt0 162.53 64.06 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 112.523 -2.126 . . . . 0.0 111.429 179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.647 ' HB2' ' CE1' ' A' ' 79' ' ' HIS . 0.6 OUTLIER 6.91 121.0 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 179.772 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.612 ' HA ' ' HG3' ' A' ' 13' ' ' GLN . 3.2 ttp . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.904 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.766 ' O ' HG12 ' A' ' 61' ' ' VAL . 73.2 t . . . . . 0 N--CA 1.456 -0.149 0 CA-C-O 121.021 0.438 . . . . 0.0 110.027 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.575 ' HA ' ' HA ' ' A' ' 82' ' ' CYS . . . 31.87 103.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.891 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.768 ' N ' ' O ' ' A' ' 81' ' ' ALA . 3.1 tptt -51.92 -36.33 48.63 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.706 0.765 . . . . 0.0 109.23 178.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.612 ' O ' ' N ' ' A' ' 80' ' ' THR . 74.9 m -150.08 118.84 6.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.39 -1.277 . . . . 0.0 109.919 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.846 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -105.23 166.31 10.5 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.531 0.681 . . . . 0.0 112.293 -178.811 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.793 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 0.1 OUTLIER -130.9 27.09 4.93 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-O 122.593 1.187 . . . . 0.0 107.921 177.399 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.686 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 12.9 ptt85 -11.0 100.7 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 112.475 -2.148 . . . . 0.0 111.689 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 1.015 HG13 ' HB2' ' A' ' 78' ' ' ASN . 4.2 m -98.32 45.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 CA-C-N 114.939 -1.028 . . . . 0.0 110.502 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.67 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 53.0 m -21.52 118.9 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.027 -179.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.831 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.2 OUTLIER -126.12 -167.49 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.784 0.802 . . . . 0.0 112.474 -178.457 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.658 ' H ' HG12 ' A' ' 70' ' ' VAL . 0.0 OUTLIER 39.17 -132.73 0.18 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.969 -179.888 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -78.97 19.65 5.13 Favored Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.735 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 113.06 41.43 0.98 Allowed Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.634 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.67 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.2 m-85 -72.53 178.6 3.96 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.604 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 5.9 mtmm -155.14 108.23 2.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.193 0.521 . . . . 0.0 111.454 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.244 HG21 ' CG2' ' A' ' 25' ' ' ILE . 15.4 m -106.59 15.02 7.52 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.483 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.337 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.846 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.6 OUTLIER 28.41 40.21 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 105.787 -1.931 . . . . 0.0 105.787 -176.876 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 1.015 ' HB2' HG13 ' A' ' 68' ' ' VAL . 29.1 t30 -4.89 68.92 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 113.402 -1.726 . . . . 0.0 108.722 -174.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.95 ' N ' HD12 ' A' ' 26' ' ' LEU . 36.4 m170 -37.77 122.11 0.95 Allowed 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 112.945 -1.934 . . . . 0.0 113.909 -176.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.612 ' N ' ' O ' ' A' ' 64' ' ' SER . 2.1 p -109.12 -11.73 14.9 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 113.048 -1.887 . . . . 0.0 109.211 178.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.768 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -172.38 142.49 1.31 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.4 179.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 8.1 m -120.82 146.22 46.78 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.679 0.276 . . . . 0.0 110.494 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.331 -0.224 0 CA-C-O 120.816 0.341 . . . . 0.0 111.8 -179.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.629 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 3.9 t . . . . . 0 CA--C 1.516 -0.36 0 CA-C-O 121.183 0.516 . . . . 0.0 111.106 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.108 ' CD2' HD13 ' A' ' 26' ' ' LEU . 8.0 mp -85.9 130.31 34.58 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.465 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.614 ' O ' ' C ' ' A' ' 14' ' ' GLU . 2.0 mt-30 -91.39 49.01 1.54 Allowed 'General case' 0 CA--C 1.5 -0.95 0 CA-C-O 121.905 0.86 . . . . 0.0 110.278 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.614 ' C ' ' O ' ' A' ' 13' ' ' GLN . 27.5 tt0 -1.15 113.81 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 113.339 -1.755 . . . . 0.0 110.864 -178.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.925 ' ND2' HG11 ' A' ' 76' ' ' VAL . 1.4 t-20 -41.0 100.69 0.23 Allowed Pre-proline 0 C--N 1.301 -1.528 0 CA-C-N 113.293 -1.776 . . . . 0.0 112.349 -179.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -68.74 4.83 1.56 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.272 1.981 . . . . 0.0 110.664 178.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.586 ' CZ ' ' HG3' ' A' ' 71' ' ' MET . 10.9 t80 -110.63 -56.47 2.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.965 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.939 ' CE2' HG13 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -73.16 -26.53 61.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.535 179.777 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.531 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 8.9 m -47.26 97.57 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.928 -179.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.627 ' O ' ' N ' ' A' ' 22' ' ' GLY . 8.7 tt0 -136.04 139.7 31.01 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.443 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.485 ' HD2' ' HG3' ' A' ' 20' ' ' GLN . 87.9 Cg_exo -35.36 81.84 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.747 2.298 . . . . 0.0 112.417 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.627 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 130.93 -6.32 5.76 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.503 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.456 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . -159.73 101.65 1.47 Allowed Pre-proline 0 CA--C 1.513 -0.463 0 CA-C-O 121.992 0.901 . . . . 0.0 111.862 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.641 ' O ' ' O ' ' A' ' 25' ' ' ILE . 91.6 Cg_endo -106.24 65.94 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.506 0 C-N-CA 124.981 3.787 . . . . 0.0 113.469 -178.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.195 ' CG2' HG21 ' A' ' 76' ' ' VAL . 16.2 mm -41.81 -176.41 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.368 179.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.108 HD13 ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -150.62 -160.52 1.18 Allowed 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -175.403 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.586 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 17.5 tt0 166.25 63.01 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 112.706 -2.043 . . . . 0.0 110.998 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.643 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 94.3 m -20.1 111.73 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.733 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.55 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.927 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.518 ' O ' ' C ' ' A' ' 62' ' ' ALA . 18.0 t . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.974 0.416 . . . . 0.0 110.342 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.739 ' HB1' ' O ' ' A' ' 64' ' ' SER . . . 13.0 99.65 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -179.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.925 ' N ' ' O ' ' A' ' 81' ' ' ALA . 0.9 OUTLIER -50.29 -35.24 26.5 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.307 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.739 ' O ' ' HB1' ' A' ' 62' ' ' ALA . 22.6 m -136.28 -174.88 3.81 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 113.768 -1.56 . . . . 0.0 108.877 179.164 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.723 ' HB3' ' HB3' ' A' ' 77' ' ' GLU . 1.8 p90 -164.05 162.97 23.38 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.498 0.666 . . . . 0.0 112.331 -179.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.827 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -134.99 29.36 3.43 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 176.468 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.736 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 1.8 ptt85 -10.76 130.0 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 112.109 -2.314 . . . . 0.0 112.368 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 1.013 HG21 HG13 ' A' ' 25' ' ' ILE . 2.5 m -135.28 38.2 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.094 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.586 ' C ' ' O ' ' A' ' 68' ' ' VAL . 23.1 m -4.5 119.23 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.661 -1.154 . . . . 0.0 112.336 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.939 HG13 ' CE2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -111.16 -161.29 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-O 121.78 0.8 . . . . 0.0 111.593 179.108 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.586 ' HG3' ' CZ ' ' A' ' 17' ' ' PHE . 3.7 mtt -30.89 153.6 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.901 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 42.13 25.85 0.29 Allowed Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.46 -0.876 . . . . 0.0 111.552 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.503 ' C ' HG23 ' A' ' 69' ' ' THR . . . 68.96 30.82 72.22 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.128 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.586 ' HB2' HG23 ' A' ' 70' ' ' VAL . 8.0 m-30 -46.59 179.36 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.625 0.25 . . . . 0.0 110.331 179.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.53 ' CG ' ' O ' ' A' ' 74' ' ' PHE . 9.7 mtpt -161.58 93.0 0.9 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.133 0.492 . . . . 0.0 111.432 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.195 HG21 ' CG2' ' A' ' 25' ' ' ILE . 27.3 m -85.82 9.1 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.486 -1.488 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.903 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.738 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 29.49 39.62 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 -177.084 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.857 ' HB2' HG13 ' A' ' 68' ' ' VAL . 61.3 t30 3.91 62.15 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 113.123 -1.853 . . . . 0.0 108.448 -174.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 1.042 ' O ' HD21 ' A' ' 12' ' ' LEU . 35.7 m170 -31.7 120.95 0.27 Allowed 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 112.778 -2.01 . . . . 0.0 113.7 -176.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.501 ' OG1' ' HB2' ' A' ' 64' ' ' SER . 7.5 p -107.7 -10.88 15.53 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 113.84 -1.527 . . . . 0.0 110.1 179.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.925 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -170.44 133.03 1.02 Allowed 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.908 178.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.594 ' SG ' ' CD1' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -116.67 142.38 46.97 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.27 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.469 ' O ' ' CG ' ' A' ' 83' ' ' HIS . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-O 120.816 0.341 . . . . 0.0 110.828 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.637 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 3.7 t . . . . . 0 CA--C 1.515 -0.382 0 CA-C-O 120.705 0.288 . . . . 0.0 110.419 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.023 HD23 HD13 ' A' ' 26' ' ' LEU . 3.9 mp -97.2 139.21 33.51 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.392 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.634 ' O ' ' O ' ' A' ' 14' ' ' GLU . 28.7 mt-30 -111.24 55.04 0.66 Allowed 'General case' 0 CA--C 1.505 -0.752 0 CA-C-O 121.658 0.742 . . . . 0.0 110.736 179.093 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.634 ' O ' ' O ' ' A' ' 13' ' ' GLN . 14.7 tt0 -0.16 122.63 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 113.651 -1.613 . . . . 0.0 111.311 -179.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.802 ' HB2' HG22 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -63.46 102.69 0.34 Allowed Pre-proline 0 C--N 1.305 -1.341 0 CA-C-N 114.107 -1.406 . . . . 0.0 112.7 -179.015 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.537 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 6.3 Cg_exo -76.72 5.09 5.08 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.632 2.221 . . . . 0.0 109.41 177.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.525 ' HB3' ' OD1' ' A' ' 15' ' ' ASN . 0.9 OUTLIER -96.85 -62.28 1.28 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 113.86 -1.518 . . . . 0.0 110.525 -179.668 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 1.132 ' CG ' HG21 ' A' ' 70' ' ' VAL . 7.3 m-85 -77.76 -4.86 48.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.86 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.488 ' HA ' ' O ' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -52.23 91.52 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.127 179.477 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.673 ' O ' ' N ' ' A' ' 22' ' ' GLY . 4.6 mt-30 -95.09 162.59 24.39 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.357 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.573 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 11.4 Cg_endo -54.86 63.48 0.03 OUTLIER 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.761 2.307 . . . . 0.0 111.802 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.673 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 143.53 1.08 1.07 Allowed Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.805 -0.712 . . . . 0.0 113.133 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.504 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -155.13 108.61 2.27 Favored Pre-proline 0 CA--C 1.518 -0.258 0 CA-C-O 122.074 0.94 . . . . 0.0 112.804 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.559 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 94.9 Cg_endo -98.78 78.52 0.05 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.073 0 C-N-CA 124.844 3.696 . . . . 0.0 112.913 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.23 ' CG2' HG21 ' A' ' 76' ' ' VAL . 5.1 mm -43.9 -176.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.026 HD23 ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.21 -164.87 2.07 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 122.343 1.068 . . . . 0.0 113.612 -176.297 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.662 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER 165.55 78.87 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 112.939 -1.937 . . . . 0.0 111.051 178.868 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.637 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -13.35 114.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.265 -179.851 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.591 ' HB2' ' CG ' ' A' ' 13' ' ' GLN . 9.8 mmm . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 120.885 0.374 . . . . 0.0 111.241 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.539 ' O ' HG12 ' A' ' 61' ' ' VAL . 61.0 t . . . . . 0 C--O 1.23 0.053 0 CA-C-O 120.723 0.297 . . . . 0.0 110.738 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.58 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 21.15 103.43 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.992 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.86 ' N ' ' O ' ' A' ' 81' ' ' ALA . 15.1 tttt -54.18 -35.67 62.58 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.538 0.685 . . . . 0.0 109.335 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.537 ' O ' ' N ' ' A' ' 80' ' ' THR . 37.1 m -146.3 127.41 14.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.379 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.854 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -112.31 166.11 11.58 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.594 0.711 . . . . 0.0 112.576 -178.343 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.715 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -133.1 29.52 4.04 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 114.612 -1.176 . . . . 0.0 108.198 177.393 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.737 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.8 OUTLIER -16.13 125.31 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 112.426 -2.17 . . . . 0.0 111.6 -179.718 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.936 HG21 ' CD1' ' A' ' 25' ' ' ILE . 2.7 m -128.57 41.92 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.328 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.65 ' C ' ' O ' ' A' ' 68' ' ' VAL . 55.0 m -9.75 118.35 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.665 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 1.132 HG21 ' CG ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -124.45 -171.1 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 121.52 0.676 . . . . 0.0 111.962 -178.765 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.476 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 42.6 mmm 34.3 -127.65 0.08 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.829 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -81.69 26.27 3.69 Favored Glycine 0 N--CA 1.44 -1.057 0 CA-C-N 115.498 -0.774 . . . . 0.0 112.566 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.607 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 104.69 43.02 1.74 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.468 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.612 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.0 m-85 -85.79 116.1 23.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.811 0.339 . . . . 0.0 111.011 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -99.65 104.5 16.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.121 0.486 . . . . 0.0 112.243 -179.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.23 HG21 ' CG2' ' A' ' 25' ' ' ILE . 12.6 m -92.32 14.64 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.361 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.755 178.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.854 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 29.18 39.94 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 105.508 -2.034 . . . . 0.0 105.508 -176.426 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.724 ' HB2' HG13 ' A' ' 68' ' ' VAL . 46.6 t30 -2.2 67.9 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.828 0 CA-C-N 113.245 -1.798 . . . . 0.0 108.53 -175.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 1.025 ' N ' HD12 ' A' ' 26' ' ' LEU . 37.6 m170 -35.49 120.48 0.56 Allowed 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 113.264 -1.789 . . . . 0.0 113.877 -176.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.537 ' N ' ' O ' ' A' ' 64' ' ' SER . 3.9 p -111.16 -11.16 14.27 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 113.514 -1.675 . . . . 0.0 110.233 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.86 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -168.83 133.4 1.54 Allowed 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.586 ' SG ' HD11 ' A' ' 12' ' ' LEU . 1.3 m -119.74 137.16 54.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.919 0.39 . . . . 0.0 111.077 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.563 ' CD2' ' O ' ' A' ' 83' ' ' HIS . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.9 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.75 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 1.7 t . . . . . 0 CA--C 1.517 -0.29 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.055 HD21 ' O ' ' A' ' 79' ' ' HIS . 6.8 mp -98.32 138.69 35.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.015 0.436 . . . . 0.0 111.812 -179.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.707 ' O ' ' O ' ' A' ' 14' ' ' GLU . 20.2 mt-30 -115.14 52.28 0.87 Allowed 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 121.713 0.768 . . . . 0.0 110.79 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.707 ' O ' ' O ' ' A' ' 13' ' ' GLN . 8.3 tt0 7.7 126.35 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 113.327 -1.76 . . . . 0.0 112.336 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.966 ' ND2' HG11 ' A' ' 76' ' ' VAL . 1.4 t-20 -53.81 108.74 1.2 Allowed Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.249 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -74.12 20.71 0.4 Allowed 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.22 1.947 . . . . 0.0 111.727 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.622 ' CZ ' ' HG2' ' A' ' 71' ' ' MET . 34.8 t80 -128.34 -55.4 1.25 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.58 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 1.023 ' CD2' HG13 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -71.69 -24.34 61.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.685 -179.772 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.664 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.2 m -40.03 92.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.182 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.607 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -124.29 138.89 31.68 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.592 -179.394 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.508 ' N ' ' OE1' ' A' ' 20' ' ' GLN . 83.4 Cg_exo -37.41 83.67 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.534 2.156 . . . . 0.0 112.08 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.607 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 127.37 -9.59 6.94 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.537 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.456 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -154.75 99.48 2.41 Favored Pre-proline 0 CA--C 1.512 -0.508 0 CA-C-O 122.011 0.91 . . . . 0.0 111.486 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.7 ' O ' ' O ' ' A' ' 25' ' ' ILE . 71.7 Cg_endo -103.63 66.67 0.03 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.57 0 C-N-CA 124.954 3.769 . . . . 0.0 112.608 -178.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.198 ' CG2' HG21 ' A' ' 76' ' ' VAL . 25.1 mm -37.59 -178.03 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.002 0 CA-C-N 115.322 -0.853 . . . . 0.0 113.284 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.922 HD13 ' O ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -153.78 -159.57 0.99 Allowed 'General case' 0 CA--C 1.498 -1.054 0 CA-C-O 122.726 1.25 . . . . 0.0 114.193 -175.343 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.598 ' O ' ' C ' ' A' ' 28' ' ' CYS . 0.8 OUTLIER 168.58 65.85 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 112.716 -2.038 . . . . 0.0 111.297 179.13 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.75 ' HA ' ' O ' ' A' ' 11' ' ' THR . 68.0 m -5.98 113.04 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.935 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.616 ' N ' ' O ' ' A' ' 11' ' ' THR . 3.3 tpp . . . . . 0 C--N 1.326 -0.444 0 CA-C-O 120.84 0.352 . . . . 0.0 111.226 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.583 ' O ' HG12 ' A' ' 61' ' ' VAL . 32.5 t . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.975 0.416 . . . . 0.0 111.478 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.712 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 40.23 114.49 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.661 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.753 ' N ' ' O ' ' A' ' 81' ' ' ALA . 13.1 tttm -56.08 -37.1 68.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.52 0.676 . . . . 0.0 109.179 178.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.648 ' O ' ' N ' ' A' ' 80' ' ' THR . 70.7 m -143.71 117.51 9.31 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.379 179.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.751 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 2.5 p90 -106.35 162.4 13.71 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.847 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -132.95 27.82 4.22 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 107.613 -1.255 . . . . 0.0 107.613 176.67 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.682 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.2 OUTLIER -6.64 129.69 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 112.201 -2.272 . . . . 0.0 112.522 -179.424 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 1.084 HG21 ' CD1' ' A' ' 25' ' ' ILE . 4.9 m -138.76 53.31 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 114.585 -1.188 . . . . 0.0 110.302 179.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.657 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 17.7 m -24.91 118.22 0.05 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.182 0.515 . . . . 0.0 111.466 -178.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 1.023 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -109.82 -171.21 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.283 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.622 ' HG2' ' CZ ' ' A' ' 17' ' ' PHE . 3.0 mtp 30.23 -149.68 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.51 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.478 ' H ' ' HB3' ' A' ' 71' ' ' MET . . . -46.76 -20.39 0.65 Allowed Glycine 0 N--CA 1.438 -1.181 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.822 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.64 ' C ' HG23 ' A' ' 69' ' ' THR . . . 152.78 32.41 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.665 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.657 ' O ' ' HA ' ' A' ' 69' ' ' THR . 9.1 m-30 -53.09 179.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.53 0.205 . . . . 0.0 110.81 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.569 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -155.0 103.4 2.39 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.883 0.373 . . . . 0.0 111.184 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.198 HG21 ' CG2' ' A' ' 25' ' ' ILE . 27.4 m -100.49 10.94 7.19 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.034 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.751 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 27.87 40.35 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 105.384 -2.08 . . . . 0.0 105.384 -177.092 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.929 ' HB2' HG13 ' A' ' 68' ' ' VAL . 48.0 t30 3.26 64.58 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 113.253 -1.794 . . . . 0.0 108.593 -174.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 1.055 ' O ' HD21 ' A' ' 12' ' ' LEU . 37.8 m170 -38.07 120.4 0.86 Allowed 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 112.779 -2.01 . . . . 0.0 113.154 -176.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.648 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.0 OUTLIER -110.19 -7.52 14.86 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 113.533 -1.667 . . . . 0.0 109.466 179.455 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.753 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -173.76 142.2 0.89 Allowed 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.253 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.658 ' SG ' HD12 ' A' ' 12' ' ' LEU . 3.2 m -115.93 163.13 16.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.305 0.574 . . . . 0.0 111.457 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.519 ' O ' ' CG ' ' A' ' 83' ' ' HIS . 6.1 p80 . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.128 179.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.716 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 0.6 OUTLIER . . . . . 0 CA--C 1.517 -0.311 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.793 HD21 ' CB ' ' A' ' 79' ' ' HIS . 10.8 mp -90.2 128.37 36.35 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.164 0.507 . . . . 0.0 111.59 -179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.619 ' O ' ' C ' ' A' ' 14' ' ' GLU . 5.0 mt-30 -96.52 46.96 1.06 Allowed 'General case' 0 CA--C 1.502 -0.867 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.775 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.79 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -0.29 117.1 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 113.775 -1.557 . . . . 0.0 110.797 -179.138 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.778 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.7 OUTLIER -54.88 101.96 0.28 Allowed Pre-proline 0 C--N 1.31 -1.119 0 CA-C-N 114.552 -1.204 . . . . 0.0 112.413 -178.637 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.592 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 61.8 Cg_endo -73.67 7.41 2.34 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 122.091 1.861 . . . . 0.0 110.003 177.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.54 ' HB3' ' OD1' ' A' ' 15' ' ' ASN . 1.5 t80 -102.81 -60.7 1.5 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.191 -1.368 . . . . 0.0 110.102 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.925 ' HD2' HG21 ' A' ' 25' ' ' ILE . 3.2 m-85 -82.93 3.76 28.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.459 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.833 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 15.0 t -64.07 99.11 0.24 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.558 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.627 ' N ' ' O ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -102.26 170.33 6.5 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.991 179.046 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.503 ' HD2' ' CB ' ' A' ' 20' ' ' GLN . 14.7 Cg_endo -57.45 73.12 0.04 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 122.454 2.103 . . . . 0.0 111.94 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.535 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 133.79 -9.61 4.89 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.359 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.627 ' O ' ' N ' ' A' ' 20' ' ' GLN . . . -146.12 104.0 4.11 Favored Pre-proline 0 CA--C 1.509 -0.6 0 CA-C-O 121.81 0.815 . . . . 0.0 111.247 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.864 ' O ' ' O ' ' A' ' 25' ' ' ILE . 78.3 Cg_endo -97.06 25.39 0.25 Allowed 'Trans proline' 0 N--CA 1.449 -1.133 0 C-N-CA 124.46 3.44 . . . . 0.0 113.477 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.176 ' CG2' HG21 ' A' ' 76' ' ' VAL . 10.7 mm 21.94 -175.03 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 114.932 -1.031 . . . . 0.0 112.843 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.968 ' H ' HG22 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -158.76 -166.08 1.79 Allowed 'General case' 0 CA--C 1.498 -1.043 0 N-CA-C 115.656 1.725 . . . . 0.0 115.656 -174.743 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.558 ' O ' ' CG ' ' A' ' 27' ' ' GLN . 0.5 OUTLIER 166.54 66.99 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 111.561 -2.563 . . . . 0.0 110.75 179.642 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.797 ' HB2' ' HD1' ' A' ' 79' ' ' HIS . 0.1 OUTLIER -19.1 116.07 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.485 -0.779 . . . . 0.0 112.117 -179.089 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.555 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.275 179.271 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.642 HG23 ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.07 0 CA-C-O 120.852 0.358 . . . . 0.0 110.52 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.587 ' HA ' ' O ' ' A' ' 81' ' ' ALA . . . 4.2 101.5 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.745 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.786 ' N ' ' O ' ' A' ' 81' ' ' ALA . 0.1 OUTLIER -54.4 -33.48 59.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.502 0.668 . . . . 0.0 109.749 178.291 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.48 ' O ' ' N ' ' A' ' 80' ' ' THR . 17.2 m -151.46 125.88 9.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.843 -1.072 . . . . 0.0 109.744 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.898 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.3 OUTLIER -106.33 163.94 12.43 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.278 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.781 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.9 OUTLIER -130.34 27.45 5.05 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 177.243 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.706 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 3.9 ptt-85 -12.39 99.81 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 112.515 -2.13 . . . . 0.0 111.623 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 1.013 HG13 ' HB2' ' A' ' 78' ' ' ASN . 8.2 m -97.61 45.9 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 CA-C-N 114.683 -1.144 . . . . 0.0 109.837 179.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.62 ' C ' ' O ' ' A' ' 68' ' ' VAL . 28.8 m -14.65 117.58 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.969 -178.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.775 HG21 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -114.06 -162.43 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 121.768 0.794 . . . . 0.0 111.996 -179.604 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.635 ' O ' ' CD2' ' A' ' 74' ' ' PHE . 9.2 mtm -21.25 143.17 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 113.855 -1.52 . . . . 0.0 112.716 -178.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 43.62 20.86 0.15 Allowed Glycine 0 N--CA 1.444 -0.791 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.768 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.467 ' O ' ' O ' ' A' ' 74' ' ' PHE . . . 81.55 27.94 45.42 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.055 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.635 ' CD2' ' O ' ' A' ' 71' ' ' MET . 38.5 m-85 -50.45 -174.51 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.69 0.281 . . . . 0.0 110.337 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.8 mttt -167.66 104.76 0.51 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.029 0.442 . . . . 0.0 112.057 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.176 HG21 ' CG2' ' A' ' 25' ' ' ILE . 16.8 m -98.13 14.8 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.36 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.392 178.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.898 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.8 OUTLIER 30.77 38.31 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 105.288 -2.115 . . . . 0.0 105.288 -176.869 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 1.013 ' HB2' HG13 ' A' ' 68' ' ' VAL . 30.4 t30 -2.52 66.88 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.974 0 CA-C-N 112.776 -2.011 . . . . 0.0 108.858 -174.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.818 ' O ' HD13 ' A' ' 26' ' ' LEU . 36.1 m170 -34.12 120.84 0.45 Allowed 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 113.349 -1.75 . . . . 0.0 112.405 -177.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.48 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.9 p -111.3 -14.25 13.82 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.368 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.786 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -165.08 138.86 4.8 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.1 OUTLIER -120.47 145.88 46.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.072 0.463 . . . . 0.0 111.5 -179.142 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.642 ' O ' HG23 ' A' ' 61' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.774 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.573 ' O ' ' N ' ' A' ' 29' ' ' MET . 11.7 t . . . . . 0 CA--C 1.518 -0.259 0 CA-C-O 121.246 0.546 . . . . 0.0 111.041 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.169 HD21 ' O ' ' A' ' 79' ' ' HIS . 4.9 mp -64.04 131.28 47.12 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.716 -179.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.669 ' O ' ' O ' ' A' ' 14' ' ' GLU . 2.1 mt-30 -114.35 59.1 0.68 Allowed 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.253 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.669 ' O ' ' O ' ' A' ' 13' ' ' GLN . 31.5 tt0 4.56 125.26 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.327 -1.761 . . . . 0.0 112.231 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.913 ' ND2' HG11 ' A' ' 76' ' ' VAL . 9.1 t-20 -51.8 123.19 24.04 Favored Pre-proline 0 C--N 1.314 -0.937 0 CA-C-N 114.407 -1.269 . . . . 0.0 111.769 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -83.31 20.44 1.17 Allowed 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 122.692 2.261 . . . . 0.0 111.559 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.615 ' CD1' ' HB ' ' A' ' 70' ' ' VAL . 29.9 t80 -133.2 -52.55 0.9 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.449 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 1.095 ' CD1' HG12 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -77.2 -10.78 59.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.964 -179.647 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.587 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -61.82 83.64 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.002 0.429 . . . . 0.0 110.682 -179.789 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.639 ' HB3' ' HD2' ' A' ' 21' ' ' PRO . 1.1 mt-30 -110.83 164.76 14.1 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.696 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.639 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 27.3 Cg_endo -61.62 61.33 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.574 2.183 . . . . 0.0 111.544 179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 157.41 -15.31 0.32 Allowed Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.469 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.539 ' O ' ' O ' ' A' ' 18' ' ' PHE . . . -148.71 104.86 3.44 Favored Pre-proline 0 CA--C 1.514 -0.415 0 CA-C-O 121.905 0.86 . . . . 0.0 111.654 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.652 ' O ' ' O ' ' A' ' 25' ' ' ILE . 92.3 Cg_endo -105.37 67.39 0.02 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.455 0 C-N-CA 124.756 3.637 . . . . 0.0 113.379 -178.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.322 ' CG2' HG21 ' A' ' 76' ' ' VAL . 29.8 mm -41.87 -173.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.032 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.753 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.058 HD11 ' OD1' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -151.51 -157.72 0.84 Allowed 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -175.192 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.529 ' O ' ' CG ' ' A' ' 27' ' ' GLN . 3.8 tt0 169.44 66.12 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 112.895 -1.957 . . . . 0.0 111.321 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.662 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 17.0 t -23.78 99.35 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.7 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.573 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.061 -179.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.572 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.877 0.37 . . . . 0.0 111.358 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.795 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 11.67 116.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.345 -0.843 . . . . 0.0 113.096 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.682 ' N ' ' O ' ' A' ' 81' ' ' ALA . 6.0 ttmm -54.53 -38.56 66.7 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 177.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.604 ' HB2' ' HB3' ' A' ' 81' ' ' ALA . 2.9 m -134.38 166.38 22.97 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.364 -1.289 . . . . 0.0 108.815 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.756 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 0.5 OUTLIER -151.4 159.28 44.32 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.165 -0.614 . . . . 0.0 112.491 -179.285 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.974 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -128.65 28.07 5.44 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 122.554 1.169 . . . . 0.0 107.903 176.798 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.612 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.5 OUTLIER -4.95 130.67 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 112.174 -2.285 . . . . 0.0 113.09 -179.496 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.943 HG11 ' CD1' ' A' ' 25' ' ' ILE . 1.6 m -144.57 46.79 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.243 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.796 HG23 ' C ' ' A' ' 73' ' ' GLY . 16.9 m -12.05 122.33 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.75 -1.113 . . . . 0.0 111.649 -179.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 1.095 HG12 ' CD1' ' A' ' 18' ' ' PHE . 3.7 m -119.03 -169.1 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.946 0.879 . . . . 0.0 112.759 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.758 ' HG2' HG23 ' A' ' 70' ' ' VAL . 0.4 OUTLIER 21.34 -120.57 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.02 -1.445 . . . . 0.0 112.529 179.917 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.405 ' H ' ' CG ' ' A' ' 71' ' ' MET . . . -70.75 31.66 0.49 Allowed Glycine 0 CA--C 1.518 0.231 0 CA-C-N 115.986 -0.552 . . . . 0.0 113.504 -178.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.796 ' C ' HG23 ' A' ' 69' ' ' THR . . . 90.85 22.1 34.34 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.685 -0.769 . . . . 0.0 111.756 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.786 ' HB2' HG22 ' A' ' 70' ' ' VAL . 0.6 OUTLIER -45.7 -178.95 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.091 0.472 . . . . 0.0 111.374 -179.887 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.558 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -154.66 82.33 1.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.369 179.543 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.322 HG21 ' CG2' ' A' ' 25' ' ' ILE . 27.2 m -78.38 12.25 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.493 -1.241 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.229 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.838 ' CG ' ' HE2' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 24.07 44.58 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 -178.364 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 1.058 ' OD1' HD11 ' A' ' 26' ' ' LEU . 31.3 t-20 6.36 63.36 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 -174.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 1.169 ' O ' HD21 ' A' ' 12' ' ' LEU . 32.2 m170 -37.98 108.79 0.09 Allowed 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.433 -176.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.559 HG23 ' O ' ' A' ' 78' ' ' ASN . 4.7 p -104.48 -5.14 21.89 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.012 -1.449 . . . . 0.0 110.702 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.682 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -162.06 144.32 11.33 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 179.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.591 ' SG ' ' CD1' ' A' ' 12' ' ' LEU . 84.5 m -121.13 157.56 29.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.062 0.458 . . . . 0.0 111.718 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.6 ' CD2' ' HA ' ' A' ' 63' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.377 179.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.846 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.512 -0.497 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.168 HD21 ' O ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER -111.5 129.53 56.02 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.156 179.226 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.629 ' HG3' ' HB2' ' A' ' 29' ' ' MET . 1.2 mt-30 -103.01 48.15 0.86 Allowed 'General case' 0 CA--C 1.502 -0.899 0 CA-C-O 121.713 0.768 . . . . 0.0 110.846 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.611 ' C ' ' O ' ' A' ' 13' ' ' GLN . 39.4 tt0 -7.12 120.69 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.52 -1.673 . . . . 0.0 110.619 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.727 ' CB ' ' HB ' ' A' ' 25' ' ' ILE . 0.4 OUTLIER -54.46 98.95 0.19 Allowed Pre-proline 0 C--N 1.306 -1.318 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.98 -178.904 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.572 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 2.8 Cg_exo -73.84 6.0 3.12 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.464 2.109 . . . . 0.0 109.224 177.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.488 ' H ' ' C ' ' A' ' 15' ' ' ASN . 1.0 OUTLIER -101.27 -54.3 2.81 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 113.671 -1.604 . . . . 0.0 110.398 -179.673 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.885 ' CD2' HG21 ' A' ' 70' ' ' VAL . 0.4 OUTLIER -86.97 -21.77 25.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.879 -179.714 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.724 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 28.2 t -37.9 107.53 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.758 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.812 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -115.0 171.29 4.59 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.945 -179.692 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -65.63 70.29 0.34 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.855 2.37 . . . . 0.0 111.601 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 135.29 -5.79 4.24 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.197 -179.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.812 ' HB3' ' HG3' ' A' ' 20' ' ' GLN . . . -151.37 102.72 2.93 Favored Pre-proline 0 CA--C 1.513 -0.459 0 CA-C-O 122.037 0.922 . . . . 0.0 111.526 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.724 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 88.6 Cg_endo -103.0 80.02 0.03 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.529 0 C-N-CA 124.788 3.659 . . . . 0.0 113.131 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.224 ' CG2' HG21 ' A' ' 76' ' ' VAL . 15.1 mm -40.8 -177.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.97 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.634 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.08 HD13 HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -152.04 -160.82 1.2 Allowed 'General case' 0 CA--C 1.498 -1.057 0 CA-C-O 122.681 1.229 . . . . 0.0 114.237 -175.624 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.527 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 4.7 tt0 159.98 62.21 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 112.348 -2.206 . . . . 0.0 110.324 179.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.753 ' SG ' ' HB3' ' A' ' 79' ' ' HIS . 75.9 m -23.35 118.69 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.275 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.629 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.387 0 CA-C-O 121.003 0.43 . . . . 0.0 111.389 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.515 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.1 OUTLIER . . . . . 0 CA--C 1.522 -0.107 0 CA-C-O 121.154 0.502 . . . . 0.0 111.288 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.771 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 44.15 112.85 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.528 179.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.673 ' HB3' ' CB ' ' A' ' 81' ' ' ALA . 19.5 ttmt -56.12 -36.69 68.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.589 0.709 . . . . 0.0 109.243 178.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.552 ' O ' ' N ' ' A' ' 80' ' ' THR . 18.5 m -147.09 135.17 21.5 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.752 -1.113 . . . . 0.0 108.62 179.249 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.726 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.3 OUTLIER -119.29 155.27 32.11 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.235 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.95 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -128.91 26.71 5.51 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 176.289 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.692 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.5 OUTLIER -4.91 127.62 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 112.58 -2.1 . . . . 0.0 111.769 -179.529 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.98 HG21 ' CD1' ' A' ' 25' ' ' ILE . 2.4 m -128.09 42.43 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.837 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.673 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 73.4 m -19.04 118.2 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.598 -179.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.885 HG21 ' CD2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -129.87 -167.5 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.732 179.741 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.611 ' HG3' ' CD2' ' A' ' 74' ' ' PHE . 0.2 OUTLIER 37.04 -137.94 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.342 -179.701 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -80.35 30.63 2.44 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.308 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.66 47.09 0.99 Allowed Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.336 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.673 ' O ' ' HA ' ' A' ' 69' ' ' THR . 9.2 m-30 -90.47 113.42 25.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.844 0.354 . . . . 0.0 110.904 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.597 ' HB3' ' OE1' ' A' ' 77' ' ' GLU . 1.9 mmmm -99.44 107.61 19.87 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.129 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.224 HG21 ' CG2' ' A' ' 25' ' ' ILE . 11.8 m -97.24 15.84 2.98 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.499 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.43 178.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.726 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 25.03 41.97 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.132 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -177.344 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.991 ' C ' HD12 ' A' ' 26' ' ' LEU . 10.9 t-20 9.19 65.58 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.998 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 -175.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 1.168 ' O ' HD21 ' A' ' 12' ' ' LEU . 25.6 m170 -42.27 89.73 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 122.455 1.122 . . . . 0.0 111.977 -175.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.716 HG22 ' OD1' ' A' ' 78' ' ' ASN . 4.2 p -79.88 -1.33 38.68 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 113.712 -1.585 . . . . 0.0 110.408 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.673 ' CB ' ' HB3' ' A' ' 63' ' ' LYS . . . -177.17 147.05 0.53 Allowed 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.826 ' SG ' HD12 ' A' ' 12' ' ' LEU . 2.7 m -116.15 164.94 13.74 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.875 0.369 . . . . 0.0 111.178 -179.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.554 ' CD2' ' HA ' ' A' ' 63' ' ' LYS . 1.9 p80 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.941 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.557 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 2.7 t . . . . . 0 CA--C 1.517 -0.301 0 CA-C-O 120.953 0.406 . . . . 0.0 110.611 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.999 HD23 HD13 ' A' ' 26' ' ' LEU . 6.5 mp -90.12 136.9 32.77 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.042 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.609 ' O ' ' O ' ' A' ' 14' ' ' GLU . 4.9 mt-30 -108.98 55.11 0.64 Allowed 'General case' 0 CA--C 1.503 -0.863 0 CA-C-O 121.739 0.781 . . . . 0.0 110.55 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.609 ' O ' ' O ' ' A' ' 13' ' ' GLN . 26.8 tt0 -1.13 122.12 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 113.419 -1.719 . . . . 0.0 111.203 -179.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.752 ' HB2' HG22 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -50.49 98.5 0.18 Allowed Pre-proline 0 C--N 1.304 -1.371 0 CA-C-N 114.154 -1.385 . . . . 0.0 111.904 -179.201 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.52 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 7.0 Cg_exo -71.8 20.45 0.27 Allowed 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 122.373 2.049 . . . . 0.0 109.592 177.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.628 ' H ' ' C ' ' A' ' 15' ' ' ASN . 1.5 t80 -125.1 -55.8 1.57 Allowed 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.157 -178.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.729 ' CD2' HG21 ' A' ' 70' ' ' VAL . 2.0 m-30 -83.12 -6.17 59.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.173 -179.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.707 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 6.1 t -60.45 83.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.769 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.79 ' O ' ' N ' ' A' ' 22' ' ' GLY . 9.0 mm100 -97.66 145.03 29.01 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.802 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -44.12 69.96 0.01 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.736 2.29 . . . . 0.0 111.459 179.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.79 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 153.06 -20.2 0.75 Allowed Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.126 -179.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.486 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -150.44 108.64 3.15 Favored Pre-proline 0 CA--C 1.515 -0.382 0 CA-C-O 121.892 0.853 . . . . 0.0 111.519 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.707 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 62.9 Cg_endo -101.74 73.06 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.35 0 C-N-CA 124.705 3.603 . . . . 0.0 113.22 -178.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.161 ' CG2' HG21 ' A' ' 76' ' ' VAL . 6.9 mm -40.63 -176.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 N-CA-C 113.483 0.919 . . . . 0.0 113.483 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.073 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER -150.21 -162.48 1.56 Allowed 'General case' 0 CA--C 1.502 -0.888 0 CA-C-O 122.635 1.207 . . . . 0.0 114.175 -175.692 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.531 ' O ' ' C ' ' A' ' 28' ' ' CYS . 10.6 tt0 164.2 77.67 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 112.661 -2.063 . . . . 0.0 110.903 179.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.622 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER -19.21 114.65 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.28 -179.568 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.544 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.8 mtp . . . . . 0 C--N 1.33 -0.269 0 CA-C-O 120.799 0.333 . . . . 0.0 111.204 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.561 ' O ' ' C ' ' A' ' 62' ' ' ALA . 6.0 t . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.702 0.286 . . . . 0.0 110.66 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.581 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 7.65 111.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.589 -179.747 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.762 ' N ' ' O ' ' A' ' 81' ' ' ALA . 6.2 tptp -55.2 -39.23 69.39 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.73 0.776 . . . . 0.0 109.377 178.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.515 ' HB3' ' OG1' ' A' ' 80' ' ' THR . 0.7 OUTLIER -147.41 133.12 18.89 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.353 179.56 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.669 ' HB2' ' C ' ' A' ' 77' ' ' GLU . 1.6 p90 -115.91 169.54 9.16 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 121.879 0.847 . . . . 0.0 112.527 -178.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.772 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -131.45 27.5 4.72 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 113.888 -1.506 . . . . 0.0 107.133 176.104 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.549 ' HA ' ' CA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -4.99 92.6 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.15 -2.296 . . . . 0.0 111.319 -179.736 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.932 HG11 HD11 ' A' ' 25' ' ' ILE . 30.1 t -94.14 71.68 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.401 0 CA-C-N 113.213 -1.812 . . . . 0.0 111.089 -179.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.68 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 99.6 m -54.09 117.72 3.46 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.174 0.511 . . . . 0.0 110.441 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.729 HG21 ' CD2' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -128.13 -166.64 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.849 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.683 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 1.5 mmm 35.89 -135.42 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.53 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -82.16 30.33 3.01 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.357 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 106.33 53.9 0.72 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.545 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.683 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 4.0 m-85 -100.42 112.88 25.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.747 0.308 . . . . 0.0 111.047 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.482 ' O ' ' OE2' ' A' ' 77' ' ' GLU . 19.0 mtpt -99.94 108.98 21.35 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.287 0.565 . . . . 0.0 111.433 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.161 HG21 ' CG2' ' A' ' 25' ' ' ILE . 15.8 m -94.76 18.0 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.486 -1.483 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.667 179.163 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.84 ' O ' ' HD2' ' A' ' 79' ' ' HIS . 0.4 OUTLIER 29.77 39.12 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 -176.099 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.924 ' HB2' HG23 ' A' ' 68' ' ' VAL . 38.3 t30 -8.02 70.08 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 113.332 -1.758 . . . . 0.0 108.582 -174.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 1.073 ' N ' HD12 ' A' ' 26' ' ' LEU . 42.5 m170 -40.5 118.04 0.89 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 112.958 -1.928 . . . . 0.0 114.246 -176.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.515 ' OG1' ' HB3' ' A' ' 64' ' ' SER . 2.3 p -103.46 -7.78 20.66 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 113.481 -1.69 . . . . 0.0 109.888 178.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.762 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -174.38 140.46 0.65 Allowed 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.543 179.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.642 ' SG ' HD11 ' A' ' 12' ' ' LEU . 1.3 m -128.54 121.56 29.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.714 0.292 . . . . 0.0 110.268 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.599 ' CD2' ' O ' ' A' ' 83' ' ' HIS . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 121.088 0.47 . . . . 0.0 111.677 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.766 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 2.9 t . . . . . 0 CA--C 1.518 -0.277 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.044 HD23 HD13 ' A' ' 26' ' ' LEU . 4.2 mp -100.86 138.87 37.34 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.085 0.469 . . . . 0.0 111.189 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.653 ' CG ' ' HB2' ' A' ' 29' ' ' MET . 2.4 mt-30 -108.92 58.67 0.6 Allowed 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.209 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.641 ' HG3' ' O ' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -4.12 122.28 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 114.03 -1.441 . . . . 0.0 111.469 -179.429 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.911 ' ND2' HG11 ' A' ' 76' ' ' VAL . 5.3 t-20 -54.92 117.93 15.66 Favored Pre-proline 0 C--N 1.311 -1.105 0 CA-C-N 114.689 -1.141 . . . . 0.0 111.939 -179.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -81.16 14.62 2.06 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.682 2.254 . . . . 0.0 111.556 179.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.471 ' CD2' ' SD ' ' A' ' 71' ' ' MET . 22.9 t80 -119.46 -55.74 2.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.146 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.841 ' CD2' HG13 ' A' ' 70' ' ' VAL . 0.7 OUTLIER -72.83 -10.67 60.06 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.152 -179.712 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.63 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 11.0 p -58.2 98.31 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.409 -179.55 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.639 ' O ' ' N ' ' A' ' 22' ' ' GLY . 6.1 mt-30 -121.96 152.76 60.14 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.905 178.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -45.28 75.79 0.01 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.178 0 C-N-CA 122.734 2.29 . . . . 0.0 112.638 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.639 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 127.86 2.76 6.09 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.556 -0.831 . . . . 0.0 113.269 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.435 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -160.19 98.17 1.46 Allowed Pre-proline 0 CA--C 1.514 -0.432 0 CA-C-O 122.084 0.945 . . . . 0.0 111.769 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.63 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 98.6 Cg_endo -107.73 81.7 0.02 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.575 0 C-N-CA 125.235 3.956 . . . . 0.0 113.5 -178.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.295 ' CG2' HG21 ' A' ' 76' ' ' VAL . 23.0 mm -44.75 -177.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.048 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -147.56 -158.79 0.95 Allowed 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 -175.386 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.519 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 6.9 tm0? 161.85 94.85 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 112.431 -2.168 . . . . 0.0 109.601 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.766 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -36.01 110.71 0.11 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.9 -178.292 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.658 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.1 tpt . . . . . 0 C--N 1.331 -0.221 0 CA-C-O 120.938 0.399 . . . . 0.0 110.068 178.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.657 HG23 ' O ' ' A' ' 61' ' ' VAL . 30.9 m . . . . . 0 CA--C 1.518 -0.264 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.715 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 18.08 103.89 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.656 -178.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.986 ' HB2' ' CD2' ' A' ' 83' ' ' HIS . 6.5 tppt? -52.84 -31.82 41.22 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 121.971 0.891 . . . . 0.0 108.858 178.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.593 ' HB3' ' OG1' ' A' ' 80' ' ' THR . 3.7 t -144.21 152.05 40.33 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 113.806 -1.543 . . . . 0.0 108.535 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.656 ' CG ' ' CG ' ' A' ' 77' ' ' GLU . 1.8 p90 -135.69 164.83 26.98 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.575 0.702 . . . . 0.0 112.093 -179.272 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.674 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 6.6 t-20 -134.66 26.36 3.7 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 122.76 1.267 . . . . 0.0 108.42 177.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.696 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -9.95 132.09 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 112.007 -2.36 . . . . 0.0 112.371 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.979 HG21 HG13 ' A' ' 25' ' ' ILE . 2.2 m -140.02 44.19 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.873 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.683 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 45.5 m -10.3 119.1 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.888 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.841 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -116.58 -168.68 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.577 0.704 . . . . 0.0 112.082 179.748 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.66 ' HG3' ' CG ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER 27.96 -139.33 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.581 -1.19 . . . . 0.0 110.954 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -69.5 10.21 2.14 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.614 179.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.463 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 129.26 55.58 0.1 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.986 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.683 ' O ' ' HA ' ' A' ' 69' ' ' THR . 2.0 m-85 -95.33 108.57 20.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.988 0.423 . . . . 0.0 111.051 -179.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.479 ' HG2' ' OG1' ' A' ' 69' ' ' THR . 5.3 mtpt -96.44 100.26 11.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.369 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.295 HG21 ' CG2' ' A' ' 25' ' ' ILE . 22.6 m -87.38 11.8 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.339 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.307 179.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.748 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 30.68 39.11 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 -177.094 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.726 ' HB2' HG13 ' A' ' 68' ' ' VAL . 52.3 t30 -3.68 67.45 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 112.98 -1.918 . . . . 0.0 109.092 -174.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 1.048 ' N ' HD12 ' A' ' 26' ' ' LEU . 42.3 m170 -37.18 119.45 0.68 Allowed 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 112.802 -1.999 . . . . 0.0 114.362 -176.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.593 ' OG1' ' HB3' ' A' ' 64' ' ' SER . 0.7 OUTLIER -108.95 -7.37 15.42 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 113.552 -1.658 . . . . 0.0 109.926 178.136 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.973 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -168.91 122.08 0.81 Allowed 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.98 178.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.488 ' SG ' HD11 ' A' ' 12' ' ' LEU . 1.3 m -119.11 120.09 36.12 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.986 ' CD2' ' HB2' ' A' ' 63' ' ' LYS . 5.5 m170 . . . . . 0 N--CA 1.466 0.325 0 CA-C-O 121.1 0.476 . . . . 0.0 112.237 -178.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.489 ' O ' ' N ' ' A' ' 29' ' ' MET . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.27 0 CA-C-O 120.893 0.378 . . . . 0.0 110.92 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.087 ' CD2' HD13 ' A' ' 26' ' ' LEU . 1.4 mp -60.35 124.25 19.76 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.654 ' HG3' ' CB ' ' A' ' 29' ' ' MET . 0.7 OUTLIER -116.67 60.52 0.74 Allowed 'General case' 0 CA--C 1.502 -0.867 0 CA-C-O 122.044 0.925 . . . . 0.0 111.723 -179.257 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.684 ' CD ' ' HB2' ' A' ' 24' ' ' PRO . 33.3 tt0 3.92 120.42 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 112.949 -1.932 . . . . 0.0 111.459 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.75 ' ND2' HG11 ' A' ' 76' ' ' VAL . 0.5 OUTLIER -53.89 100.74 0.23 Allowed Pre-proline 0 C--N 1.307 -1.264 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.562 -179.608 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.616 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 56.8 Cg_endo -69.98 5.4 1.8 Allowed 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 121.702 1.602 . . . . 0.0 109.951 178.054 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.597 ' CZ ' ' SD ' ' A' ' 71' ' ' MET . 0.3 OUTLIER -101.47 -60.64 1.49 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 113.992 -1.458 . . . . 0.0 110.847 -179.779 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.914 ' CD2' HG21 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -82.67 -2.17 53.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.651 -179.576 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.629 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -59.27 83.77 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.598 179.647 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.56 ' O ' ' N ' ' A' ' 22' ' ' GLY . 4.2 mt-30 -92.94 164.88 20.09 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.407 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.16 59.22 0.17 Allowed 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 122.527 2.151 . . . . 0.0 111.174 179.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.56 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 154.7 -14.93 0.53 Allowed Glycine 0 N--CA 1.449 -0.461 0 CA-C-N 115.716 -0.674 . . . . 0.0 112.549 -179.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.437 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -142.52 105.16 5.45 Favored Pre-proline 0 CA--C 1.513 -0.448 0 CA-C-O 121.916 0.865 . . . . 0.0 111.374 -179.588 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.684 ' HB2' ' CD ' ' A' ' 14' ' ' GLU . 71.9 Cg_endo -104.05 75.93 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.391 0 C-N-CA 124.687 3.592 . . . . 0.0 114.358 -177.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.275 ' CG2' HG21 ' A' ' 76' ' ' VAL . 15.2 mm -44.17 -175.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 178.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.087 HD13 ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -148.65 -161.19 1.29 Allowed 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -176.879 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.652 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 20.8 tt0 161.79 82.91 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 112.421 -2.172 . . . . 0.0 110.822 179.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 1.3 m -35.06 101.83 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.774 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.654 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.372 0 CA-C-O 120.889 0.376 . . . . 0.0 111.225 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.598 HG13 ' O ' ' A' ' 61' ' ' VAL . 7.1 p . . . . . 0 N--CA 1.457 -0.098 0 CA-C-O 120.75 0.309 . . . . 0.0 110.739 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.587 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 9.11 107.31 0.0 OUTLIER 'General case' 0 C--O 1.231 0.103 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.164 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.882 ' N ' ' O ' ' A' ' 81' ' ' ALA . 2.4 ttmm -55.35 -39.3 69.89 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.652 0.739 . . . . 0.0 109.372 178.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.513 ' N ' ' HB3' ' A' ' 81' ' ' ALA . 2.4 m -144.13 135.03 25.23 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.108 179.362 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.868 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.2 OUTLIER -119.45 160.59 22.06 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.128 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.936 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -123.6 27.65 7.29 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-O 122.5 1.143 . . . . 0.0 107.938 177.423 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.539 ' O ' ' O ' ' A' ' 66' ' ' ASN . 1.9 ttm180 -6.33 128.67 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 112.311 -2.222 . . . . 0.0 112.237 -179.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.979 HG21 ' CD1' ' A' ' 25' ' ' ILE . 1.5 m -134.64 36.04 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.954 179.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.594 ' C ' ' O ' ' A' ' 68' ' ' VAL . 23.4 m -17.34 120.55 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.471 -179.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.914 HG21 ' CD2' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -125.92 -168.01 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-O 121.718 0.771 . . . . 0.0 112.447 -178.457 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.601 ' H ' HG12 ' A' ' 70' ' ' VAL . 0.5 OUTLIER 43.86 -134.49 0.57 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.411 -1.268 . . . . 0.0 111.062 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.439 ' H ' ' HB3' ' A' ' 71' ' ' MET . . . -84.94 23.02 8.25 Favored Glycine 0 N--CA 1.434 -1.45 0 C-N-CA 120.71 -0.757 . . . . 0.0 111.694 179.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 118.03 37.09 0.9 Allowed Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.183 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.586 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 3.3 m-85 -68.64 -177.66 1.0 Allowed 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 1.5 mtmp? -159.53 134.37 7.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.273 0.559 . . . . 0.0 111.972 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.275 HG21 ' CG2' ' A' ' 25' ' ' ILE . 18.8 m -140.07 15.22 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.492 -1.255 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.476 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.868 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 20.42 46.58 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -178.069 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.989 ' OD1' HD11 ' A' ' 26' ' ' LEU . 27.4 t-20 1.18 70.78 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 114.262 -1.335 . . . . 0.0 108.215 -174.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 1.02 ' O ' HD21 ' A' ' 12' ' ' LEU . 33.6 m170 -39.36 111.42 0.18 Allowed 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 122.582 1.182 . . . . 0.0 111.957 -176.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.664 HG23 ' O ' ' A' ' 78' ' ' ASN . 8.9 p -108.16 -9.33 15.58 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.601 -1.636 . . . . 0.0 110.101 -179.375 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.882 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -165.42 128.55 2.19 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 178.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.1 OUTLIER -117.67 143.39 46.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.668 0.271 . . . . 0.0 110.753 -178.935 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.448 ' NE2' ' HA ' ' A' ' 63' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.332 -0.193 0 CA-C-O 120.867 0.365 . . . . 0.0 111.516 -179.473 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.593 ' O ' ' N ' ' A' ' 29' ' ' MET . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.243 0 CA-C-O 120.847 0.356 . . . . 0.0 111.388 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.102 HD21 ' O ' ' A' ' 79' ' ' HIS . 3.5 mp -51.2 123.07 8.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.243 179.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.704 ' O ' ' O ' ' A' ' 14' ' ' GLU . 2.0 mm-40 -123.34 61.45 1.05 Allowed 'General case' 0 CA--C 1.502 -0.895 0 CA-C-O 122.251 1.024 . . . . 0.0 110.933 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.704 ' O ' ' O ' ' A' ' 13' ' ' GLN . 16.6 tt0 8.29 126.92 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 112.484 -2.144 . . . . 0.0 112.313 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.866 ' ND2' HG11 ' A' ' 76' ' ' VAL . 1.4 t-20 -49.86 128.96 21.11 Favored Pre-proline 0 C--N 1.311 -1.096 0 CA-C-N 114.232 -1.349 . . . . 0.0 111.253 179.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -86.06 27.87 0.57 Allowed 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.598 2.198 . . . . 0.0 111.517 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.565 ' HB2' ' HE1' ' A' ' 71' ' ' MET . 54.2 t80 -143.29 -52.65 0.36 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.924 -179.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.966 ' CE2' HG23 ' A' ' 68' ' ' VAL . 0.2 OUTLIER -74.86 -15.43 60.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.28 -179.163 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.92 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -55.5 92.54 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.315 -179.547 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.541 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.1 OUTLIER -121.07 166.51 15.66 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-O 120.916 0.388 . . . . 0.0 111.147 179.803 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.5 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 31.2 Cg_exo -59.28 64.46 0.06 OUTLIER 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.992 2.461 . . . . 0.0 112.194 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.541 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 144.94 -9.89 1.81 Allowed Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.35 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.499 ' O ' ' O ' ' A' ' 18' ' ' PHE . . . -153.19 99.13 2.71 Favored Pre-proline 0 CA--C 1.51 -0.583 0 CA-C-O 122.02 0.914 . . . . 0.0 111.798 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.92 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 71.7 Cg_endo -107.64 72.71 0.02 OUTLIER 'Trans proline' 0 N--CA 1.436 -1.878 0 C-N-CA 124.965 3.777 . . . . 0.0 113.251 -178.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.237 ' CG2' HG21 ' A' ' 76' ' ' VAL . 22.7 mm -40.09 -176.89 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.043 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.158 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.018 HD11 ' OD1' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -148.58 -159.58 1.05 Allowed 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 122.484 1.135 . . . . 0.0 113.826 -176.356 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.539 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 1.2 tp-100 160.01 75.29 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 112.921 -1.945 . . . . 0.0 110.802 179.646 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 2.3 m -22.74 111.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.618 -179.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.593 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.8 OUTLIER . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.638 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.745 HG13 ' O ' ' A' ' 61' ' ' VAL . 4.3 p . . . . . 0 CA--C 1.511 -0.528 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.763 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 37.29 113.78 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.527 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.74 ' N ' ' O ' ' A' ' 81' ' ' ALA . 4.3 ttmm -52.33 -39.66 60.93 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.674 0.75 . . . . 0.0 109.014 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.529 ' HB3' ' OG1' ' A' ' 80' ' ' THR . 4.4 m -141.13 139.78 34.01 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.971 178.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.684 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 7.2 p90 -123.51 159.38 29.24 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.181 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.928 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -126.71 26.07 6.3 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 122.825 1.298 . . . . 0.0 107.826 176.87 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.522 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -3.0 129.75 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 111.912 -2.404 . . . . 0.0 113.766 -179.273 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.966 HG23 ' CE2' ' A' ' 18' ' ' PHE . 1.9 m -149.26 87.7 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.962 178.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.663 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 98.7 m -57.5 127.0 29.82 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.6 0.714 . . . . 0.0 111.955 -178.04 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.831 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -126.27 -170.23 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 114.684 -1.144 . . . . 0.0 111.124 179.383 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.565 ' HE1' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER 30.55 -136.55 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.058 179.592 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -73.23 21.57 1.06 Allowed Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.695 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.642 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 115.54 33.75 1.54 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.555 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.663 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.2 m-85 -69.0 110.46 4.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.106 0.479 . . . . 0.0 111.233 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.81 89.63 5.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.807 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.237 HG21 ' CG2' ' A' ' 25' ' ' ILE . 25.5 m -78.76 13.89 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.495 -1.155 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.904 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.7 ' O ' ' C ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER 23.76 44.74 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 105.685 -1.969 . . . . 0.0 105.685 -177.698 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 1.018 ' OD1' HD11 ' A' ' 26' ' ' LEU . 26.6 t-20 1.48 71.96 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.096 0 CA-C-N 114.196 -1.365 . . . . 0.0 108.371 -174.22 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 1.102 ' O ' HD21 ' A' ' 12' ' ' LEU . 36.4 m170 -41.85 111.6 0.25 Allowed 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 122.644 1.211 . . . . 0.0 111.93 -176.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.582 HG23 ' O ' ' A' ' 78' ' ' ASN . 7.6 p -104.53 -3.32 24.05 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 113.6 -1.637 . . . . 0.0 109.628 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.74 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -171.96 138.6 1.05 Allowed 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.2 OUTLIER -120.86 157.24 30.23 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.729 -0.389 . . . . 0.0 111.325 -179.031 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.463 ' CD2' ' O ' ' A' ' 83' ' ' HIS . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.343 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.903 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.517 -0.313 0 CA-C-O 120.634 0.254 . . . . 0.0 110.326 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.119 HD21 ' O ' ' A' ' 79' ' ' HIS . 0.5 OUTLIER -114.38 129.71 56.66 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.668 179.83 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.668 ' HG3' ' CB ' ' A' ' 29' ' ' MET . 1.8 mm-40 -97.84 44.83 1.03 Allowed 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 121.7 0.762 . . . . 0.0 110.81 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.797 ' HG3' HD23 ' A' ' 26' ' ' LEU . 5.9 tt0 -5.22 122.8 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 113.617 -1.629 . . . . 0.0 110.945 -179.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.852 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.6 OUTLIER -69.38 105.07 0.91 Allowed Pre-proline 0 C--N 1.309 -1.156 0 CA-C-N 114.691 -1.14 . . . . 0.0 113.095 -178.343 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.516 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 3.7 Cg_exo -78.33 3.81 6.82 Favored 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 122.819 2.346 . . . . 0.0 109.472 177.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.507 ' HB3' ' OD1' ' A' ' 15' ' ' ASN . 1.3 t80 -94.61 -63.35 1.19 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 113.874 -1.512 . . . . 0.0 110.08 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 1.059 ' CG ' HG21 ' A' ' 70' ' ' VAL . 8.4 m-85 -79.7 -0.39 33.89 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.362 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.769 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -53.94 104.18 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.942 -179.793 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.712 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 0.3 OUTLIER -106.43 177.17 1.41 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.833 179.85 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.525 ' HD2' ' HB2' ' A' ' 20' ' ' GLN . 35.1 Cg_exo -59.55 68.23 0.06 OUTLIER 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.676 2.251 . . . . 0.0 112.018 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.528 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 124.65 19.51 2.51 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.395 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.712 ' HB3' ' HG3' ' A' ' 20' ' ' GLN . . . -167.0 100.77 0.64 Allowed Pre-proline 0 CA--C 1.509 -0.61 0 CA-C-O 121.952 0.882 . . . . 0.0 110.971 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.793 ' O ' ' O ' ' A' ' 25' ' ' ILE . 28.1 Cg_endo -94.35 23.85 0.42 Allowed 'Trans proline' 0 N--CA 1.452 -0.968 0 C-N-CA 124.525 3.484 . . . . 0.0 113.049 -178.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.143 ' CG2' HG21 ' A' ' 76' ' ' VAL . 9.8 mm 25.38 -174.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 114.684 -1.144 . . . . 0.0 113.046 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.091 HD13 ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -159.75 -160.61 0.83 Allowed 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -174.723 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.595 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 2.6 tp60 161.27 59.5 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 112.176 -2.284 . . . . 0.0 110.477 179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.687 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 73.6 m -15.87 121.29 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.266 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.668 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.757 179.063 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.849 ' O ' HG12 ' A' ' 61' ' ' VAL . 25.3 t . . . . . 0 C--O 1.23 0.071 0 CA-C-O 121.15 0.5 . . . . 0.0 110.354 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.819 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 26.18 92.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.431 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.86 ' N ' ' O ' ' A' ' 81' ' ' ALA . 8.6 tptp -47.04 -33.84 5.19 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 177.496 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.746 ' O ' ' HB1' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -139.34 -175.61 4.24 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 113.833 -1.531 . . . . 0.0 108.646 178.982 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.907 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -158.88 162.98 37.0 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.554 0.692 . . . . 0.0 112.246 -179.466 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.789 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.2 OUTLIER -133.84 27.53 3.94 Favored 'General case' 0 CA--C 1.504 -0.817 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 176.777 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.631 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -8.66 129.9 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 112.205 -2.27 . . . . 0.0 111.935 -179.607 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 1.029 HG21 ' CD1' ' A' ' 25' ' ' ILE . 4.3 m -134.04 46.85 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.759 179.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.565 ' C ' ' O ' ' A' ' 68' ' ' VAL . 41.1 m -20.09 118.56 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.993 -178.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 1.059 HG21 ' CG ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -123.41 -170.0 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.109 -179.048 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.639 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 80.7 mtp 38.99 -134.23 0.14 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.635 179.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -75.87 12.33 8.99 Favored Glycine 0 N--CA 1.441 -0.992 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.976 -179.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 122.1 37.67 0.64 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.236 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.639 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 7.1 m-85 -67.14 -176.27 0.53 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.94 92.85 0.87 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.722 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.143 HG21 ' CG2' ' A' ' 25' ' ' ILE . 29.8 m -86.24 10.6 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.342 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.907 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.5 OUTLIER 30.53 39.38 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 -176.986 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.974 ' HB2' HG13 ' A' ' 68' ' ' VAL . 48.7 t30 1.75 64.69 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 113.081 -1.872 . . . . 0.0 108.26 -174.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 1.119 ' O ' HD21 ' A' ' 12' ' ' LEU . 32.8 m170 -31.73 121.49 0.27 Allowed 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 112.764 -2.017 . . . . 0.0 113.28 -176.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.565 ' OG1' ' HB2' ' A' ' 64' ' ' SER . 6.9 p -111.08 -13.64 14.02 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 113.999 -1.455 . . . . 0.0 110.568 -179.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.86 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -164.18 135.26 4.42 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.458 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.944 ' SG ' HD12 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -114.03 127.1 55.79 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.474 -0.49 . . . . 0.0 112.23 -178.765 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.494 ' O ' ' CG ' ' A' ' 83' ' ' HIS . 1.7 p80 . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.934 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.644 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 0.3 OUTLIER . . . . . 0 CA--C 1.508 -0.648 0 CA-C-O 121.339 0.59 . . . . 0.0 111.973 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.242 HD21 ' O ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER -67.59 113.33 5.32 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.997 -1.002 . . . . 0.0 109.602 178.205 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.605 ' HG3' ' HB2' ' A' ' 29' ' ' MET . 1.3 mm-40 -101.77 52.75 0.82 Allowed 'General case' 0 CA--C 1.499 -0.997 0 CA-C-O 122.119 0.962 . . . . 0.0 110.527 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.595 ' C ' ' O ' ' A' ' 13' ' ' GLN . 4.7 tt0 -4.47 118.0 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 112.761 -2.018 . . . . 0.0 110.845 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.697 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.4 OUTLIER -54.63 102.54 0.31 Allowed Pre-proline 0 C--N 1.302 -1.489 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.382 -178.787 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.454 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 1.4 Cg_endo -76.65 1.33 8.62 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.223 1.949 . . . . 0.0 109.046 177.349 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.736 ' CE1' ' HE1' ' A' ' 71' ' ' MET . 1.1 t80 -93.51 -53.64 3.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 113.518 -1.674 . . . . 0.0 110.08 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.88 ' CE2' HG21 ' A' ' 70' ' ' VAL . 4.0 m-85 -87.5 -4.98 58.99 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.63 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.646 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.7 OUTLIER -48.46 97.36 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.346 179.402 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.62 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -101.23 158.28 32.09 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.667 -179.511 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.438 ' CD ' ' HG3' ' A' ' 20' ' ' GLN . 32.5 Cg_exo -57.98 65.76 0.05 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.582 2.188 . . . . 0.0 111.044 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.62 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 134.66 1.06 3.49 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.168 -179.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -150.82 99.99 3.1 Favored Pre-proline 0 CA--C 1.512 -0.519 0 CA-C-O 122.022 0.915 . . . . 0.0 111.424 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.646 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 93.2 Cg_endo -103.23 78.87 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.414 0 C-N-CA 124.809 3.673 . . . . 0.0 113.318 -178.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.182 ' CG2' HG21 ' A' ' 76' ' ' VAL . 15.3 mm -40.45 -177.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.014 HD13 HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -150.75 -162.76 1.62 Allowed 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 122.413 1.102 . . . . 0.0 113.662 -175.856 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.546 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 7.5 tp-100 166.92 59.76 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 112.918 -1.947 . . . . 0.0 111.104 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.644 ' HA ' ' O ' ' A' ' 11' ' ' THR . 7.4 t -28.2 99.71 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.975 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.605 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 8.2 tpt . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.206 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.606 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.043 0 CA-C-O 120.788 0.328 . . . . 0.0 110.349 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.834 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 21.12 111.56 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.435 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.639 ' N ' ' O ' ' A' ' 81' ' ' ALA . 2.5 ttmt -52.04 -36.76 51.33 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 178.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.615 ' O ' ' HB1' ' A' ' 62' ' ' ALA . 3.5 m -136.09 178.02 7.38 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.273 -1.331 . . . . 0.0 108.863 179.116 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.707 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 2.7 p90 -158.27 157.09 31.85 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.085 -0.646 . . . . 0.0 112.572 -179.639 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.92 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 0.4 OUTLIER -127.42 24.99 6.17 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-O 122.705 1.24 . . . . 0.0 107.989 176.501 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.684 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 3.3 ptt85 -2.87 120.05 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 112.144 -2.298 . . . . 0.0 112.198 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 1.017 HG21 ' CD1' ' A' ' 25' ' ' ILE . 2.5 m -124.42 45.23 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.504 179.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.61 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 94.5 m -20.12 119.55 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 121.17 0.509 . . . . 0.0 110.747 -178.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.88 HG21 ' CE2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -122.88 -164.02 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.005 -179.169 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.736 ' HE1' ' CE1' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -28.3 138.72 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.45 -1.25 . . . . 0.0 111.323 -179.583 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 57.04 11.94 6.68 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.005 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 70' ' ' VAL . . . 74.96 39.29 38.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.141 -179.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.61 ' O ' ' HA ' ' A' ' 69' ' ' THR . 12.9 m-85 -73.48 114.51 11.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.95 0.405 . . . . 0.0 111.219 -179.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.7 mtmm -95.57 95.81 8.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.734 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.182 HG21 ' CG2' ' A' ' 25' ' ' ILE . 26.8 m -83.59 10.7 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.35 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.707 ' O ' ' CB ' ' A' ' 65' ' ' TYR . 0.3 OUTLIER 28.15 40.44 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 -177.145 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.92 ' HB3' ' CA ' ' A' ' 66' ' ' ASN . 9.9 t-20 8.96 63.17 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.991 0 CA-C-N 113.932 -1.485 . . . . 0.0 107.42 -175.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 1.242 ' O ' HD21 ' A' ' 12' ' ' LEU . 28.5 m170 -37.76 99.8 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.233 0 CA-C-O 122.498 1.142 . . . . 0.0 111.781 -175.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.721 HG23 ' O ' ' A' ' 78' ' ' ASN . 10.2 p -95.9 0.25 51.76 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 113.781 -1.554 . . . . 0.0 111.347 -178.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.639 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -167.8 146.81 4.78 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.038 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.862 ' SG ' HD12 ' A' ' 12' ' ' LEU . 84.2 m -120.4 170.19 9.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.827 0.346 . . . . 0.0 111.428 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.936 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.848 ' O ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.223 -0.293 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.266 HD21 ' O ' ' A' ' 79' ' ' HIS . 8.5 mp -145.74 127.04 14.86 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.865 0.364 . . . . 0.0 111.348 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.585 ' O ' ' C ' ' A' ' 14' ' ' GLU . 2.9 mm-40 -92.81 46.6 1.24 Allowed 'General case' 0 CA--C 1.504 -0.813 0 CA-C-O 121.799 0.809 . . . . 0.0 110.397 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.6 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 4.1 tt0 -0.59 117.63 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 113.522 -1.672 . . . . 0.0 111.419 -178.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.984 ' ND2' HG11 ' A' ' 76' ' ' VAL . 1.2 t-20 -58.76 103.93 0.39 Allowed Pre-proline 0 C--N 1.306 -1.288 0 CA-C-N 113.957 -1.474 . . . . 0.0 111.214 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.43 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 3.0 Cg_exo -74.27 14.85 0.68 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.914 2.409 . . . . 0.0 112.167 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.427 ' CE2' ' HG2' ' A' ' 71' ' ' MET . 58.9 t80 -113.42 -50.84 2.84 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.415 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 1.081 ' CD1' HG12 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -79.82 -11.17 59.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.237 -179.549 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.598 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -52.36 104.36 0.09 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.63 -179.391 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.596 ' CG ' ' O ' ' A' ' 18' ' ' PHE . 0.9 OUTLIER -123.14 166.13 19.4 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.581 179.402 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.05 76.99 0.02 OUTLIER 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.703 2.269 . . . . 0.0 112.501 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 119.81 10.23 7.8 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.516 -0.849 . . . . 0.0 112.982 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.424 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -161.38 98.1 1.28 Allowed Pre-proline 0 CA--C 1.512 -0.504 0 CA-C-O 122.141 0.972 . . . . 0.0 112.227 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.605 ' O ' ' O ' ' A' ' 25' ' ' ILE . 74.2 Cg_endo -106.55 82.45 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.549 1 C-N-CA 125.301 4.001 . . . . 0.0 111.958 -179.356 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.304 ' CG2' HG21 ' A' ' 76' ' ' VAL . 32.8 mm -42.01 -176.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.005 HD13 ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -155.92 -156.97 0.68 Allowed 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 115.028 1.492 . . . . 0.0 115.028 -173.579 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.53 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 1.3 tp-100 160.78 72.19 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 112.637 -2.074 . . . . 0.0 110.575 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.836 ' SG ' ' HB3' ' A' ' 79' ' ' HIS . 73.8 m -21.39 114.15 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.86 -179.078 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.535 ' CE ' ' OE1' ' A' ' 13' ' ' GLN . 7.1 tpp . . . . . 0 C--N 1.327 -0.402 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.828 ' O ' HG12 ' A' ' 61' ' ' VAL . 40.5 t . . . . . 0 C--O 1.231 0.085 0 CA-C-O 121.059 0.457 . . . . 0.0 110.675 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.648 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 32.33 105.59 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.515 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.777 ' N ' ' O ' ' A' ' 81' ' ' ALA . 23.1 tptt -54.49 -42.14 70.4 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.704 0.764 . . . . 0.0 108.946 177.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.579 ' O ' ' N ' ' A' ' 80' ' ' THR . 50.0 m -141.94 123.28 14.82 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.577 179.212 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.735 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 0.4 OUTLIER -114.14 158.86 20.73 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.639 0.733 . . . . 0.0 112.93 -177.81 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.944 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -128.55 30.35 5.16 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 176.466 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.687 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -7.6 133.49 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 112.17 -2.286 . . . . 0.0 112.401 -179.35 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 1.043 HG21 HG13 ' A' ' 25' ' ' ILE . 2.4 m -139.47 45.17 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.87 -179.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.667 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 21.8 m -10.75 119.18 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.649 -179.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 1.081 HG12 ' CD1' ' A' ' 18' ' ' PHE . 4.6 m -120.61 -169.81 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.787 0.804 . . . . 0.0 112.635 -178.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.614 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 11.1 mtt 37.12 -125.44 0.19 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.304 -1.317 . . . . 0.0 111.087 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -87.74 36.51 3.35 Favored Glycine 0 N--CA 1.437 -1.29 0 CA-C-N 115.399 -0.819 . . . . 0.0 112.682 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.565 ' C ' HG23 ' A' ' 69' ' ' THR . . . 104.33 21.27 9.5 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.118 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.676 ' CB ' HG22 ' A' ' 70' ' ' VAL . 3.8 m-85 -52.15 -177.84 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.607 0.241 . . . . 0.0 111.01 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.563 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -154.34 106.39 2.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 179.753 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.304 HG21 ' CG2' ' A' ' 25' ' ' ILE . 22.8 m -104.95 12.49 8.14 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.368 0 CA-C-O 121.043 0.449 . . . . 0.0 110.477 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.735 ' O ' ' CB ' ' A' ' 65' ' ' TYR . 0.4 OUTLIER 23.7 43.88 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 -178.282 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.944 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 15.6 t-20 8.2 64.74 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.967 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 -175.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 1.266 ' O ' HD21 ' A' ' 12' ' ' LEU . 26.5 m170 -41.36 90.61 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 122.362 1.077 . . . . 0.0 112.437 -175.412 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.667 HG23 ' O ' ' A' ' 78' ' ' ASN . 4.2 p -83.29 -4.32 58.32 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 113.946 -1.479 . . . . 0.0 110.146 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.777 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -176.23 141.04 0.42 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.616 ' SG ' ' O ' ' A' ' 11' ' ' THR . 1.5 m -114.87 151.68 33.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.825 0.345 . . . . 0.0 110.95 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.615 ' CD2' ' O ' ' A' ' 83' ' ' HIS . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.247 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.936 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.672 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 0.2 OUTLIER . . . . . 0 CA--C 1.508 -0.66 0 CA-C-O 121.457 0.646 . . . . 0.0 111.886 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.182 HD21 ' O ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER -67.82 120.31 13.93 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.139 178.553 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.647 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.1 mt-30 -111.0 56.48 0.63 Allowed 'General case' 0 CA--C 1.501 -0.929 0 CA-C-O 122.015 0.912 . . . . 0.0 110.814 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.647 ' O ' ' O ' ' A' ' 13' ' ' GLN . 23.8 tt0 2.91 121.49 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 112.703 -2.044 . . . . 0.0 111.194 -179.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.669 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.4 OUTLIER -48.91 99.23 0.21 Allowed Pre-proline 0 C--N 1.306 -1.318 0 CA-C-N 114.455 -1.248 . . . . 0.0 111.697 -179.289 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.596 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 40.4 Cg_endo -66.51 5.0 0.81 Allowed 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 121.88 1.72 . . . . 0.0 109.765 178.031 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.612 ' CZ ' ' SD ' ' A' ' 71' ' ' MET . 0.6 OUTLIER -103.65 -56.93 2.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 113.883 -1.508 . . . . 0.0 110.514 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.679 ' HB2' ' HB ' ' A' ' 25' ' ' ILE . 0.6 OUTLIER -87.63 -2.33 58.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.007 -179.666 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.774 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.3 m -60.0 86.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.645 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.756 ' CG ' ' HB3' ' A' ' 23' ' ' ALA . 3.4 pt20 -108.67 154.37 41.72 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.788 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -57.14 66.74 0.04 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.23 0 C-N-CA 122.563 2.175 . . . . 0.0 111.232 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.631 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 149.56 -15.36 1.09 Allowed Glycine 0 N--CA 1.449 -0.438 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.681 -179.031 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.756 ' HB3' ' CG ' ' A' ' 20' ' ' GLN . . . -148.21 99.39 3.68 Favored Pre-proline 0 CA--C 1.51 -0.576 0 CA-C-O 122.007 0.908 . . . . 0.0 110.822 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.774 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 62.5 Cg_endo -104.57 66.36 0.02 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.692 0 C-N-CA 124.718 3.612 . . . . 0.0 113.755 -178.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.149 ' CG2' HG21 ' A' ' 76' ' ' VAL . 15.4 mm -39.75 -179.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 N-CA-C 112.789 0.662 . . . . 0.0 112.789 179.174 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.001 ' HB3' HD23 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -148.52 -163.01 1.68 Allowed 'General case' 0 CA--C 1.497 -1.078 0 CA-C-O 122.624 1.202 . . . . 0.0 113.992 -176.073 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.586 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 8.6 tp60 167.77 62.66 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 112.501 -2.136 . . . . 0.0 111.005 179.439 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.672 ' HA ' ' O ' ' A' ' 11' ' ' THR . 1.2 t -28.74 99.72 0.02 OUTLIER 'General case' 0 C--O 1.23 0.075 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.065 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.575 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 19.0 tpp . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.037 -179.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.68 HG13 ' O ' ' A' ' 61' ' ' VAL . 11.4 p . . . . . 0 C--O 1.231 0.095 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.64 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 24.54 106.88 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.456 -179.344 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.804 ' N ' ' O ' ' A' ' 81' ' ' ALA . 9.7 ttmm -55.25 -42.66 73.78 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 177.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.512 ' N ' ' HB3' ' A' ' 81' ' ' ALA . 0.7 OUTLIER -136.9 136.81 38.98 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.251 -1.341 . . . . 0.0 108.901 178.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.692 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 6.2 p90 -126.2 160.94 28.87 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.141 0.496 . . . . 0.0 112.264 -178.045 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.89 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 1.2 t30 -126.08 27.03 6.39 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-O 122.51 1.148 . . . . 0.0 107.945 176.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.594 ' HG3' ' HA ' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -9.57 122.94 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 112.466 -2.152 . . . . 0.0 111.367 -179.46 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.958 HG21 ' CD1' ' A' ' 25' ' ' ILE . 2.4 m -119.47 40.81 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.186 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.707 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 48.0 m -18.08 118.39 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.282 -179.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.906 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.2 OUTLIER -131.76 -167.37 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-O 121.608 0.718 . . . . 0.0 112.215 -178.544 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.634 ' H ' HG12 ' A' ' 70' ' ' VAL . 0.0 OUTLIER 42.32 -131.57 0.53 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.755 -179.839 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -83.7 36.5 2.82 Favored Glycine 0 N--CA 1.435 -1.394 0 CA-C-N 115.263 -0.881 . . . . 0.0 112.099 179.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 94.55 47.0 2.84 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.034 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.707 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.5 m-85 -78.28 178.53 7.57 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.657 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -155.59 110.18 2.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.984 0.421 . . . . 0.0 111.669 -179.876 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.149 HG21 ' CG2' ' A' ' 25' ' ' ILE . 10.1 m -107.5 10.59 9.12 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.416 0 CA-C-O 121.288 0.566 . . . . 0.0 109.686 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.772 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER 28.54 40.12 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 -177.601 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.89 ' HB3' ' CA ' ' A' ' 66' ' ' ASN . 13.9 t-20 5.95 62.26 0.0 OUTLIER 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 -176.105 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 1.182 ' O ' HD21 ' A' ' 12' ' ' LEU . 28.4 m170 -37.17 103.67 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.252 0 CA-C-O 122.409 1.1 . . . . 0.0 112.026 -175.239 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.76 HG23 ' O ' ' A' ' 78' ' ' ASN . 7.8 p -102.44 -5.58 23.92 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 113.777 -1.556 . . . . 0.0 111.32 -178.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.804 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -167.2 135.34 2.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 15.6 m -115.84 155.14 28.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.832 0.349 . . . . 0.0 111.095 -179.109 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.566 ' CD2' ' O ' ' A' ' 83' ' ' HIS . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.226 0 CA-C-O 120.964 0.411 . . . . 0.0 111.075 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.648 ' O ' ' N ' ' A' ' 29' ' ' MET . 9.2 t . . . . . 0 CA--C 1.512 -0.506 0 CA-C-O 120.821 0.343 . . . . 0.0 110.098 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.853 HD23 HD13 ' A' ' 26' ' ' LEU . 4.6 mp -79.76 136.72 36.82 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.554 -179.532 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.629 ' O ' ' O ' ' A' ' 14' ' ' GLU . 42.9 mt-30 -115.39 60.53 0.7 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.212 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.629 ' O ' ' O ' ' A' ' 13' ' ' GLN . 20.9 tt0 2.8 121.2 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.752 -179.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 1.007 ' ND2' HG11 ' A' ' 70' ' ' VAL . 1.5 t-20 -51.71 113.07 3.67 Favored Pre-proline 0 C--N 1.306 -1.311 0 CA-C-N 113.866 -1.515 . . . . 0.0 112.139 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_endo -79.86 18.16 1.18 Allowed 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.418 2.079 . . . . 0.0 111.607 178.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.574 ' CD2' ' SD ' ' A' ' 71' ' ' MET . 15.6 t80 -124.88 -55.28 1.61 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.487 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 1.213 ' CD1' HG12 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -73.03 -16.17 61.5 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.829 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.489 ' HB3' ' O ' ' A' ' 15' ' ' ASN . 4.2 p -49.18 88.05 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.627 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.599 ' O ' ' N ' ' A' ' 22' ' ' GLY . 4.3 mt-30 -113.58 160.21 32.57 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.063 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.14 67.21 0.03 OUTLIER 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.757 2.304 . . . . 0.0 112.19 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.599 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 144.54 -5.45 1.58 Allowed Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.811 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.435 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -153.46 105.32 2.56 Favored Pre-proline 0 CA--C 1.515 -0.376 0 CA-C-O 122.006 0.907 . . . . 0.0 111.858 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.672 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.4 Cg_endo -102.95 68.26 0.03 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.457 0 C-N-CA 124.904 3.736 . . . . 0.0 112.528 -179.332 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.216 ' CG2' HG21 ' A' ' 76' ' ' VAL . 24.4 mm -39.82 -174.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -179.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.035 HD23 ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -153.63 -159.21 0.95 Allowed 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -174.858 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.492 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 1.9 tt0 160.16 101.61 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 112.661 -2.063 . . . . 0.0 110.062 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.55 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -47.11 103.71 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.115 -179.005 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.648 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.935 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.591 HG23 ' CD2' ' A' ' 83' ' ' HIS . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.175 0 CA-C-O 120.7 0.286 . . . . 0.0 110.57 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.661 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . -5.71 102.73 0.01 OUTLIER 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 122.071 0.938 . . . . 0.0 112.317 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.858 ' HG3' ' C ' ' A' ' 81' ' ' ALA . 0.1 OUTLIER -50.8 -44.85 59.05 Favored 'General case' 0 CA--C 1.49 -1.33 0 CA-C-N 113.613 -1.63 . . . . 0.0 108.597 178.028 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.678 ' O ' ' N ' ' A' ' 80' ' ' THR . 37.2 m -138.96 112.48 8.25 Favored 'General case' 0 N--CA 1.425 -1.677 0 CA-C-N 113.625 -1.625 . . . . 0.0 110.395 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.696 ' CG ' ' CG ' ' A' ' 77' ' ' GLU . 0.9 OUTLIER -99.66 164.25 12.14 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.843 -178.823 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.795 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -134.65 29.16 3.56 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 177.317 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.563 ' O ' ' O ' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -6.18 129.98 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 112.099 -2.319 . . . . 0.0 112.487 -179.678 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 1.049 HG21 HG13 ' A' ' 25' ' ' ILE . 3.2 m -141.04 47.31 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.593 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.677 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 20.1 m -6.92 118.64 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.138 -179.075 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 1.213 HG12 ' CD1' ' A' ' 18' ' ' PHE . 5.4 m -119.01 -169.48 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.867 0.841 . . . . 0.0 112.851 -178.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.593 ' HG2' HG23 ' A' ' 70' ' ' VAL . 3.0 mmt 34.51 -127.86 0.09 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.212 -1.358 . . . . 0.0 111.517 179.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -83.02 35.81 2.73 Favored Glycine 0 N--CA 1.44 -1.06 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.585 -179.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.527 ' C ' HG23 ' A' ' 69' ' ' THR . . . 103.33 19.24 12.74 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.869 -0.682 . . . . 0.0 112.027 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.738 ' HB2' ' CG2' ' A' ' 70' ' ' VAL . 3.0 m-85 -52.03 -176.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.656 0.265 . . . . 0.0 111.038 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.582 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 18.9 mtmm -153.36 94.85 1.86 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.902 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.216 HG21 ' CG2' ' A' ' 25' ' ' ILE . 31.7 m -86.44 10.77 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.359 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.633 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.727 ' O ' ' HD2' ' A' ' 79' ' ' HIS . 0.1 OUTLIER 26.46 42.01 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 105.666 -1.975 . . . . 0.0 105.666 -177.632 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.95 ' HB2' HG13 ' A' ' 68' ' ' VAL . 51.6 t30 -0.86 69.98 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.846 0 CA-C-N 113.51 -1.677 . . . . 0.0 109.16 -174.209 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 1.031 ' N ' HD12 ' A' ' 26' ' ' LEU . 41.3 m170 -43.34 111.76 0.31 Allowed 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 113.472 -1.694 . . . . 0.0 113.5 -176.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.678 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.5 p -91.71 -33.58 14.98 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 113.731 -1.577 . . . . 0.0 108.413 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.858 ' C ' ' HG3' ' A' ' 63' ' ' LYS . . . -149.55 150.04 31.64 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 177.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.9 OUTLIER -129.35 130.41 46.04 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.075 0.464 . . . . 0.0 111.674 -179.612 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.645 ' HB3' ' HD2' ' A' ' 63' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.463 0.181 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.615 -179.718 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.768 0.318 . . . . 0.0 111.218 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.888 HD21 ' O ' ' A' ' 79' ' ' HIS . 6.0 mp -54.66 130.86 41.92 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.977 178.912 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.671 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.8 mm-40 -127.57 62.31 1.38 Allowed 'General case' 0 CA--C 1.506 -0.727 0 CA-C-O 122.357 1.075 . . . . 0.0 111.734 -179.853 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.686 ' O ' ' HD3' ' A' ' 16' ' ' PRO . 0.9 OUTLIER 6.46 125.87 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 112.241 -2.254 . . . . 0.0 112.295 179.538 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.772 ' ND2' HG11 ' A' ' 76' ' ' VAL . 0.5 OUTLIER -56.15 100.2 0.21 Allowed Pre-proline 0 C--N 1.314 -0.944 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.889 179.782 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.686 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 66.0 Cg_endo -72.86 4.81 3.35 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 121.738 1.625 . . . . 0.0 109.315 177.342 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.542 ' CD2' ' CE1' ' A' ' 18' ' ' PHE . 1.1 t80 -106.02 -57.87 1.99 Allowed 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 113.724 -1.58 . . . . 0.0 110.364 -179.839 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.945 ' CG ' HG21 ' A' ' 70' ' ' VAL . 3.6 m-30 -81.58 0.67 37.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.622 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.49 102.95 0.6 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.012 179.899 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.607 ' HB3' ' HD2' ' A' ' 21' ' ' PRO . 12.9 mt-30 -111.54 162.21 22.02 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.286 179.607 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.607 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 24.9 Cg_endo -60.47 66.37 0.08 OUTLIER 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.647 2.232 . . . . 0.0 111.812 179.773 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.537 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 147.14 -10.96 1.37 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.345 -179.623 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.473 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -146.89 106.38 3.95 Favored Pre-proline 0 CA--C 1.514 -0.441 0 CA-C-O 121.858 0.837 . . . . 0.0 111.349 -179.662 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.569 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 97.3 Cg_endo -104.03 75.44 0.03 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.573 0 C-N-CA 124.752 3.634 . . . . 0.0 113.083 -178.48 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.268 ' CG2' HG21 ' A' ' 76' ' ' VAL . 15.5 mm -44.47 -175.35 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.911 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.003 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -146.04 -166.36 2.44 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 -176.026 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.534 ' O ' ' C ' ' A' ' 28' ' ' CYS . 0.0 OUTLIER 164.32 75.17 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 112.501 -2.136 . . . . 0.0 111.993 178.735 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.707 ' SG ' HD12 ' A' ' 12' ' ' LEU . 14.1 m -23.53 101.0 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.709 179.211 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.3 ttt . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.894 -179.388 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.761 ' O ' HG22 ' A' ' 61' ' ' VAL . 2.2 p . . . . . 0 CA--C 1.522 -0.106 0 CA-C-O 120.728 0.299 . . . . 0.0 110.214 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.594 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 10.64 104.29 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.073 -179.224 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 1.046 ' N ' ' O ' ' A' ' 81' ' ' ALA . 70.4 tttt -53.35 -36.29 61.18 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 178.148 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.468 ' N ' ' HB3' ' A' ' 81' ' ' ALA . 8.0 m -139.08 163.01 33.54 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.326 -1.306 . . . . 0.0 108.558 178.867 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.764 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.7 OUTLIER -144.57 159.29 43.04 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.616 -179.236 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.878 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 0.9 OUTLIER -124.28 24.83 7.94 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 122.677 1.227 . . . . 0.0 107.817 176.88 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.551 ' O ' ' O ' ' A' ' 66' ' ' ASN . 3.9 ttt180 1.0 121.53 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 111.997 -2.365 . . . . 0.0 112.04 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 1.003 HG21 ' CD1' ' A' ' 25' ' ' ILE . 1.5 m -128.27 39.81 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.893 179.668 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.664 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 47.8 m -21.45 118.61 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.062 -179.454 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.945 HG21 ' CG ' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -121.29 -168.87 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.775 0.797 . . . . 0.0 112.636 -178.767 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.473 ' HB2' ' CD2' ' A' ' 74' ' ' PHE . 61.0 mmm 30.17 -131.45 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.127 -1.397 . . . . 0.0 111.571 -179.918 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -63.04 -0.39 3.03 Favored Glycine 0 N--CA 1.442 -0.923 0 CA-C-N 115.342 -0.845 . . . . 0.0 113.271 -179.694 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.532 ' N ' ' O ' ' A' ' 70' ' ' VAL . . . 119.62 37.11 0.8 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.156 -179.782 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.664 ' O ' ' HA ' ' A' ' 69' ' ' THR . 32.2 m-85 -64.08 -178.67 0.36 Allowed 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.498 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.619 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -153.87 95.13 1.84 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -179.576 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.268 HG21 ' CG2' ' A' ' 25' ' ' ILE . 14.1 m -92.15 16.89 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.494 -1.201 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.323 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.764 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 22.38 45.12 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 -177.934 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.878 ' HB3' ' CA ' ' A' ' 66' ' ' ASN . 9.0 t-20 3.16 71.13 0.0 OUTLIER 'General case' 0 CA--C 1.498 -1.041 0 CA-C-N 114.407 -1.269 . . . . 0.0 107.601 -175.226 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 1.003 ' N ' HD12 ' A' ' 26' ' ' LEU . 33.2 m170 -41.99 115.06 0.61 Allowed 'General case' 0 C--N 1.304 -1.383 0 CA-C-O 122.372 1.082 . . . . 0.0 111.475 -176.277 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.786 HG23 ' O ' ' A' ' 78' ' ' ASN . 11.0 p -114.02 -2.83 13.42 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 113.779 -1.555 . . . . 0.0 110.761 -178.578 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 1.046 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -168.35 112.48 0.61 Allowed 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.79 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.525 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.5 OUTLIER -99.87 153.96 18.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.692 0.282 . . . . 0.0 110.838 -179.284 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.738 ' NE2' HG13 ' A' ' 61' ' ' VAL . 1.6 p80 . . . . . 0 C--N 1.329 -0.292 0 CA-C-O 120.942 0.401 . . . . 0.0 111.092 -179.975 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.831 ' O ' ' N ' ' A' ' 29' ' ' MET . 0.1 OUTLIER . . . . . 0 CA--C 1.508 -0.666 0 CA-C-O 121.158 0.504 . . . . 0.0 110.157 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.281 HD21 ' O ' ' A' ' 79' ' ' HIS . 0.8 OUTLIER -74.98 135.77 41.33 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.462 -179.224 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.635 ' O ' ' O ' ' A' ' 14' ' ' GLU . 6.8 mt-30 -122.18 54.15 1.19 Allowed 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 121.715 0.769 . . . . 0.0 109.707 177.808 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.635 ' O ' ' O ' ' A' ' 13' ' ' GLN . 5.0 tt0 -2.93 125.66 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 113.495 -1.684 . . . . 0.0 111.445 -178.546 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.754 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.5 OUTLIER -62.16 106.0 0.74 Allowed Pre-proline 0 C--N 1.309 -1.173 0 CA-C-N 114.335 -1.302 . . . . 0.0 112.274 -179.176 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.407 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 4.3 Cg_exo -77.19 10.88 2.25 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 122.531 2.154 . . . . 0.0 109.415 177.453 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.564 ' CE1' ' SD ' ' A' ' 71' ' ' MET . 0.9 OUTLIER -106.48 -61.15 1.56 Allowed 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.138 -1.392 . . . . 0.0 111.296 -179.196 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.811 ' CG ' HG21 ' A' ' 70' ' ' VAL . 5.2 m-85 -81.72 -3.22 53.14 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.714 -178.718 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.707 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 58.4 p -58.75 89.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.974 0.416 . . . . 0.0 110.723 -179.886 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.589 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -88.57 165.99 25.18 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.933 179.731 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.453 ' CD ' ' HG3' ' A' ' 20' ' ' GLN . 22.6 Cg_endo -61.43 59.02 0.11 Allowed 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 122.348 2.032 . . . . 0.0 111.452 179.638 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.589 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 157.39 -16.53 0.34 Allowed Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 115.773 -0.648 . . . . 0.0 112.622 -179.534 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.508 ' HB3' HE21 ' A' ' 20' ' ' GLN . . . -145.22 109.25 4.6 Favored Pre-proline 0 CA--C 1.517 -0.324 0 CA-C-O 121.966 0.889 . . . . 0.0 112.168 -179.316 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.707 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 69.0 Cg_endo -101.81 78.81 0.04 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.284 0 C-N-CA 124.912 3.741 . . . . 0.0 113.401 -179.086 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.185 ' CG2' HG21 ' A' ' 76' ' ' VAL . 5.6 mm -39.18 -176.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.992 HD13 ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -152.98 -160.12 1.09 Allowed 'General case' 0 CA--C 1.503 -0.856 0 CA-C-O 122.509 1.147 . . . . 0.0 113.955 -175.974 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.565 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 14.2 tt0 162.75 78.24 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 112.853 -1.976 . . . . 0.0 111.339 179.392 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.802 ' HA ' ' O ' ' A' ' 11' ' ' THR . 77.1 m -25.52 100.24 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.174 179.885 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.831 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.942 179.8 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.79 ' O ' HG12 ' A' ' 61' ' ' VAL . 56.7 t . . . . . 0 CA--C 1.519 -0.22 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.818 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 10.23 108.36 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.514 -0.766 . . . . 0.0 112.196 -179.621 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.821 ' N ' ' O ' ' A' ' 81' ' ' ALA . 36.5 tttt -51.81 -33.36 35.41 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.582 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.54 ' O ' ' HB1' ' A' ' 62' ' ' ALA . 13.8 m -141.3 165.3 27.89 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.943 179.075 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.656 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 0.3 OUTLIER -147.22 161.83 40.14 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.239 0.542 . . . . 0.0 111.936 -179.356 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.806 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.1 OUTLIER -134.5 29.59 3.57 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-O 122.74 1.257 . . . . 0.0 107.698 176.787 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.555 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -9.76 128.73 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 112.029 -2.35 . . . . 0.0 112.163 -179.458 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 1.038 HG21 ' CD1' ' A' ' 25' ' ' ILE . 4.3 m -136.06 48.35 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 114.812 -1.086 . . . . 0.0 110.282 179.883 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.605 ' C ' ' O ' ' A' ' 68' ' ' VAL . 89.1 m -20.08 118.27 0.03 OUTLIER 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.048 -179.304 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.811 HG21 ' CG ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -120.48 -172.05 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-O 121.428 0.632 . . . . 0.0 112.525 -178.039 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.564 ' SD ' ' CE1' ' A' ' 17' ' ' PHE . 29.0 mmm 33.2 -127.64 0.06 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.791 -1.095 . . . . 0.0 111.147 -179.275 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -78.71 9.88 34.38 Favored Glycine 0 N--CA 1.438 -1.218 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.651 -179.817 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.555 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 128.68 24.76 1.08 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.763 179.969 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.567 ' O ' ' HA ' ' A' ' 69' ' ' THR . 5.7 m-30 -69.7 118.49 12.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.796 0.331 . . . . 0.0 110.999 -179.791 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.442 ' HB3' ' CD ' ' A' ' 67' ' ' ARG . 0.4 OUTLIER -105.87 110.64 23.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.071 0.462 . . . . 0.0 111.892 -179.668 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.185 HG21 ' CG2' ' A' ' 25' ' ' ILE . 17.7 m -95.21 12.05 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.439 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.44 178.958 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.72 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER 29.69 39.34 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 105.47 -2.048 . . . . 0.0 105.47 -176.636 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.874 ' C ' HD12 ' A' ' 26' ' ' LEU . 55.3 t30 3.11 64.11 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.682 0 CA-C-N 113.341 -1.754 . . . . 0.0 108.405 -174.562 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 1.281 ' O ' HD21 ' A' ' 12' ' ' LEU . 35.8 m170 -38.0 114.05 0.32 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 113.399 -1.728 . . . . 0.0 112.818 -176.689 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.54 ' OG1' ' CB ' ' A' ' 64' ' ' SER . 3.0 p -98.54 -7.3 28.53 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 114.388 -1.278 . . . . 0.0 110.339 -179.734 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.821 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -169.32 136.8 1.8 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.89 178.741 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.915 ' SG ' HD12 ' A' ' 12' ' ' LEU . 6.9 m -119.67 119.37 33.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.653 0.263 . . . . 0.0 110.636 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.584 ' CD2' ' O ' ' A' ' 83' ' ' HIS . 0.5 OUTLIER . . . . . 0 C--N 1.325 -0.483 0 CA-C-O 120.917 0.389 . . . . 0.0 110.156 178.996 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.67 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.235 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.947 HD23 HD13 ' A' ' 26' ' ' LEU . 3.3 mp -116.21 141.23 48.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.002 0.43 . . . . 0.0 111.034 179.825 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.735 ' CG ' ' HA ' ' A' ' 29' ' ' MET . 1.3 mt-30 -98.93 45.75 1.0 Allowed 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 121.292 0.568 . . . . 0.0 110.896 179.778 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.653 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 0.9 OUTLIER -5.92 117.92 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.835 -178.729 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.796 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.5 OUTLIER -58.26 103.53 0.37 Allowed Pre-proline 0 C--N 1.304 -1.378 0 CA-C-N 114.063 -1.426 . . . . 0.0 112.455 -178.659 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.558 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 86.2 Cg_endo -77.4 4.36 5.99 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 122.119 1.879 . . . . 0.0 109.289 177.4 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.607 ' CE2' ' SD ' ' A' ' 71' ' ' MET . 0.8 OUTLIER -95.08 -64.41 1.07 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 113.659 -1.61 . . . . 0.0 109.742 179.563 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.831 ' CG ' HG21 ' A' ' 70' ' ' VAL . 7.8 m-85 -74.82 -4.4 37.55 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.994 179.339 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.61 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -57.69 88.57 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.542 179.856 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.723 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.8 OUTLIER -95.3 155.9 38.3 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.057 179.715 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -48.98 69.04 0.02 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.726 2.284 . . . . 0.0 111.754 179.709 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.723 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 137.25 -0.45 2.87 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.77 -179.572 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.544 ' O ' ' HA ' ' A' ' 19' ' ' SER . . . -153.94 104.39 2.47 Favored Pre-proline 0 CA--C 1.517 -0.311 0 CA-C-O 121.806 0.812 . . . . 0.0 112.178 -179.551 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.616 ' O ' ' O ' ' A' ' 25' ' ' ILE . 63.2 Cg_endo -104.64 76.64 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 125.133 3.889 . . . . 0.0 113.491 -178.725 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.167 ' CG2' HG21 ' A' ' 76' ' ' VAL . 10.1 mm -40.64 -173.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 179.728 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.027 HD23 ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -151.51 -162.73 1.59 Allowed 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -176.298 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.648 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 35.7 tp60 168.18 50.97 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 113.099 -1.864 . . . . 0.0 111.967 179.55 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.605 ' O ' ' O ' ' A' ' 27' ' ' GLN . 0.8 OUTLIER 26.55 119.14 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 178.705 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.735 ' HA ' ' CG ' ' A' ' 13' ' ' GLN . 1.9 ttp . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.304 177.921 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.534 ' O ' ' O ' ' A' ' 62' ' ' ALA . 2.2 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.811 0.338 . . . . 0.0 110.83 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.66 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 26.11 106.88 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.749 0 CA-C-O 121.993 0.902 . . . . 0.0 112.471 -179.969 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.883 ' HG3' ' CB ' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -49.46 -47.14 48.57 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 113.724 -1.58 . . . . 0.0 107.708 177.023 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.642 ' OG ' ' HB3' ' A' ' 81' ' ' ALA . 2.1 p -128.52 156.19 43.67 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 113.193 -1.822 . . . . 0.0 109.243 179.304 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.704 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -141.31 160.81 39.34 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.59 0.709 . . . . 0.0 112.424 -178.308 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.785 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -127.87 28.32 5.6 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-O 122.703 1.239 . . . . 0.0 107.684 177.378 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.524 ' HD3' ' HB3' ' A' ' 75' ' ' LYS . 0.9 OUTLIER -9.23 126.27 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 112.115 -2.311 . . . . 0.0 112.033 -179.688 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.993 HG21 HG13 ' A' ' 25' ' ' ILE . 3.1 m -129.55 43.03 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.212 179.466 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.577 ' C ' ' O ' ' A' ' 68' ' ' VAL . 53.9 m -16.16 118.95 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.136 -179.303 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.831 HG21 ' CG ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -125.75 -169.23 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.856 -179.574 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.607 ' SD ' ' CE2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER 41.91 -135.57 0.3 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.977 -1.011 . . . . 0.0 110.862 -179.704 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -78.94 21.14 4.13 Favored Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.667 179.935 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 114.88 41.09 0.86 Allowed Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.296 -179.982 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.562 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 3.2 m-85 -70.21 -175.73 1.03 Allowed 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 179.894 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.585 ' N ' ' CD ' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -160.15 94.39 1.1 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -179.552 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.167 HG21 ' CG2' ' A' ' 25' ' ' ILE . 31.4 m -88.98 11.8 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.491 -1.309 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.014 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.758 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 27.14 42.35 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 105.336 -2.098 . . . . 0.0 105.336 -176.81 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.914 ' HB2' HG13 ' A' ' 68' ' ' VAL . 57.4 t30 -1.69 67.21 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.828 0 CA-C-N 113.302 -1.772 . . . . 0.0 108.597 -174.414 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 1.016 ' N ' HD12 ' A' ' 26' ' ' LEU . 37.6 m170 -34.27 122.33 0.49 Allowed 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 112.747 -2.024 . . . . 0.0 114.094 -176.493 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.554 ' OG1' ' CB ' ' A' ' 64' ' ' SER . 6.5 p -107.68 -34.25 7.05 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 113.483 -1.69 . . . . 0.0 109.513 178.362 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.883 ' CB ' ' HG3' ' A' ' 63' ' ' LYS . . . -143.17 143.41 31.78 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.808 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.578 ' CA ' ' HG2' ' A' ' 63' ' ' LYS . 1.2 m -129.6 129.86 44.92 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.943 -179.318 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.818 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 0.3 OUTLIER . . . . . 0 CA--C 1.522 -0.108 0 CA-C-O 121.07 0.462 . . . . 0.0 111.08 179.278 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.881 ' O ' HD12 ' A' ' 12' ' ' LEU . 1.2 t . . . . . 0 CA--C 1.518 -0.26 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.895 HD23 HD13 ' A' ' 26' ' ' LEU . 11.1 mp -133.55 129.95 37.77 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.001 0.429 . . . . 0.0 110.919 179.644 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.655 ' O ' ' O ' ' A' ' 14' ' ' GLU . 28.1 mt-30 -106.64 55.51 0.66 Allowed 'General case' 0 CA--C 1.504 -0.824 0 CA-C-O 121.444 0.64 . . . . 0.0 111.717 -179.083 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.655 ' O ' ' O ' ' A' ' 13' ' ' GLN . 26.1 tt0 0.03 122.66 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 113.872 -1.513 . . . . 0.0 111.279 -179.611 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.936 ' ND2' HG11 ' A' ' 76' ' ' VAL . 1.0 OUTLIER -51.44 104.34 0.42 Allowed Pre-proline 0 C--N 1.303 -1.422 0 CA-C-N 113.916 -1.493 . . . . 0.0 112.826 -179.116 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.695 ' HD2' ' CE1' ' A' ' 17' ' ' PHE . 55.3 Cg_endo -69.27 7.7 0.81 Allowed 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.161 1.908 . . . . 0.0 112.121 178.943 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.697 ' CZ ' ' OD1' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -112.42 -58.95 2.07 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.22 178.778 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.867 ' CD2' HG13 ' A' ' 70' ' ' VAL . 0.4 OUTLIER -71.34 -17.03 62.46 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.556 -178.929 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.575 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -51.13 84.07 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.965 -179.606 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.57 ' O ' ' N ' ' A' ' 22' ' ' GLY . 11.4 mm100 -118.51 159.93 41.91 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.06 -179.855 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.474 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 12.9 Cg_endo -55.3 72.84 0.03 OUTLIER 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.868 2.379 . . . . 0.0 111.515 179.298 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.57 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 142.92 -13.35 2.39 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.961 -0.637 . . . . 0.0 111.903 -179.344 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.486 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -150.55 102.22 3.09 Favored Pre-proline 0 CA--C 1.511 -0.525 0 CA-C-O 122.023 0.916 . . . . 0.0 111.826 -179.79 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.665 ' O ' ' O ' ' A' ' 25' ' ' ILE . 87.3 Cg_endo -104.18 60.47 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.543 0 C-N-CA 124.873 3.715 . . . . 0.0 112.433 -179.112 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.168 ' CG2' HG21 ' A' ' 76' ' ' VAL . 19.9 mm -38.63 -175.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-N 114.916 -1.038 . . . . 0.0 113.544 -179.839 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.071 HD23 ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.13 -160.85 1.2 Allowed 'General case' 0 CA--C 1.503 -0.862 0 CA-C-O 122.398 1.094 . . . . 0.0 113.699 -174.99 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.571 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 16.6 tt0 163.63 66.2 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 113.179 -1.828 . . . . 0.0 111.261 179.298 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.683 ' HA ' ' O ' ' A' ' 11' ' ' THR . 38.9 t -18.96 115.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.573 179.874 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.511 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 0.6 OUTLIER . . . . . 0 C--N 1.324 -0.503 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.354 179.629 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.65 ' O ' ' O ' ' A' ' 62' ' ' ALA . 31.0 m . . . . . 0 N--CA 1.452 -0.347 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.65 ' O ' ' O ' ' A' ' 61' ' ' VAL . . . 24.06 107.93 0.0 OUTLIER 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.976 -178.621 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.923 ' HB2' ' CD2' ' A' ' 83' ' ' HIS . 1.2 ttmt -51.38 -36.24 42.43 Favored 'General case' 0 CA--C 1.503 -0.855 0 CA-C-O 121.797 0.808 . . . . 0.0 109.452 179.614 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.591 ' OG ' ' HB3' ' A' ' 81' ' ' ALA . 2.0 p -143.84 142.16 30.7 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.193 -1.367 . . . . 0.0 109.044 178.864 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.672 ' CG ' ' CG ' ' A' ' 77' ' ' GLU . 1.1 p90 -129.54 165.92 20.72 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.672 0.749 . . . . 0.0 112.601 -178.775 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.789 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -133.96 27.48 3.9 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 114.401 -1.272 . . . . 0.0 107.76 176.688 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.674 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -6.86 121.91 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 112.077 -2.329 . . . . 0.0 112.053 179.911 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 1.055 HG21 ' CD1' ' A' ' 25' ' ' ILE . 3.8 m -129.16 44.12 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.055 179.516 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.71 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 36.6 m -18.09 118.0 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.68 -178.799 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.867 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -110.92 -163.42 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.772 0.796 . . . . 0.0 111.812 179.538 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.644 ' HG3' ' CD2' ' A' ' 74' ' ' PHE . 2.4 ptm -34.14 145.57 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.393 -1.276 . . . . 0.0 111.519 -179.555 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 54.3 10.56 2.01 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.659 -0.782 . . . . 0.0 111.977 -179.532 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.501 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 80.68 33.84 29.62 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.192 -179.854 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.71 ' O ' ' HA ' ' A' ' 69' ' ' THR . 9.6 m-85 -65.44 110.29 2.62 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.988 0.423 . . . . 0.0 111.016 -179.873 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.498 ' CD ' ' OG1' ' A' ' 69' ' ' THR . 9.6 mmmt -94.1 98.48 11.02 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.525 -179.837 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.168 HG21 ' CG2' ' A' ' 25' ' ' ILE . 30.1 m -87.53 10.98 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.489 -1.381 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.136 179.149 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.783 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER 27.45 41.43 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 -177.396 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 1.01 ' HB2' HG13 ' A' ' 68' ' ' VAL . 45.0 t30 -0.67 64.95 0.0 OUTLIER 'General case' 0 CA--C 1.501 -0.916 0 CA-C-N 113.371 -1.741 . . . . 0.0 108.542 -174.48 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 1.001 ' N ' HD12 ' A' ' 26' ' ' LEU . 36.9 m170 -37.12 122.05 0.84 Allowed 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 112.75 -2.023 . . . . 0.0 113.746 -176.503 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.573 ' OG1' ' HB2' ' A' ' 64' ' ' SER . 2.6 p -108.29 -8.86 15.59 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 113.504 -1.68 . . . . 0.0 109.622 178.718 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.795 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -173.99 137.52 0.57 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.81 179.001 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.776 ' C ' ' CD2' ' A' ' 83' ' ' HIS . 1.8 t -127.7 131.26 49.79 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.7 0.286 . . . . 0.0 111.164 179.855 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.923 ' CD2' ' HB2' ' A' ' 63' ' ' LYS . 3.9 m-70 . . . . . 0 C--N 1.324 -0.541 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.642 -179.821 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.616 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.456 -0.13 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 . . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.876 HD23 HD13 ' A' ' 26' ' ' LEU . 1.5 mp -114.94 140.88 48.65 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.714 0.293 . . . . 0.0 110.368 179.633 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.761 ' HG3' ' HA ' ' A' ' 29' ' ' MET . 3.1 mm-40 -101.2 50.08 0.87 Allowed 'General case' 0 CA--C 1.499 -0.991 0 CA-C-O 121.936 0.874 . . . . 0.0 111.204 -179.41 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.651 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 2.2 tt0 -0.25 120.12 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 113.183 -1.826 . . . . 0.0 111.554 -179.4 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.972 ' ND2' HG11 ' A' ' 76' ' ' VAL . 1.1 t-20 -52.55 120.29 17.82 Favored Pre-proline 0 C--N 1.308 -1.204 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.56 -179.815 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -82.34 16.93 1.67 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.479 2.119 . . . . 0.0 112.094 179.592 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.629 ' CE2' ' HG3' ' A' ' 71' ' ' MET . 86.9 t80 -123.73 -54.69 1.74 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.874 -179.921 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.957 ' CD1' HG12 ' A' ' 70' ' ' VAL . 0.3 OUTLIER -75.09 -7.47 53.83 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.318 -179.353 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.625 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -60.0 101.58 0.13 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.651 -179.308 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.593 ' CB ' ' HD2' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -115.41 177.45 1.19 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.265 179.334 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.593 ' HD2' ' CB ' ' A' ' 20' ' ' GLN . 59.5 Cg_endo -71.44 60.38 2.64 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.484 2.122 . . . . 0.0 111.748 179.566 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 149.65 -10.06 0.92 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.499 -179.576 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -146.95 99.4 4.0 Favored Pre-proline 0 CA--C 1.509 -0.625 0 CA-C-O 122.15 0.976 . . . . 0.0 112.021 -179.657 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.63 ' O ' ' O ' ' A' ' 25' ' ' ILE . 98.0 Cg_endo -104.8 79.94 0.02 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.707 0 C-N-CA 125.094 3.863 . . . . 0.0 112.687 -179.054 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.233 ' CG2' HG21 ' A' ' 76' ' ' VAL . 24.3 mm -42.56 -173.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-N 115.509 -0.769 . . . . 0.0 113.019 -179.939 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.005 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -152.97 -159.18 0.97 Allowed 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 -174.822 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.671 ' O ' ' O ' ' A' ' 28' ' ' CYS . 4.0 tm0? 166.04 56.96 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 112.603 -2.09 . . . . 0.0 111.143 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.671 ' O ' ' O ' ' A' ' 27' ' ' GLN . 0.8 OUTLIER 18.37 119.16 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.918 179.876 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.761 ' HA ' ' HG3' ' A' ' 13' ' ' GLN . 5.8 tmm? . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.899 179.041 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.839 ' O ' HG22 ' A' ' 61' ' ' VAL . 1.3 p . . . . . 0 CA--C 1.521 -0.156 0 CA-C-O 120.963 0.411 . . . . 0.0 110.298 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.745 ' HB1' ' O ' ' A' ' 64' ' ' SER . . . 3.03 103.32 0.01 OUTLIER 'General case' 0 CA--C 1.504 -0.793 0 CA-C-O 121.913 0.863 . . . . 0.0 112.559 -179.294 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.81 ' HG3' ' C ' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -48.36 -44.19 34.24 Favored 'General case' 0 CA--C 1.49 -1.327 0 CA-C-N 113.845 -1.525 . . . . 0.0 107.134 177.014 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.749 ' HB3' ' OG1' ' A' ' 80' ' ' THR . 14.2 t -125.54 -178.61 4.3 Favored 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 112.849 -1.978 . . . . 0.0 109.407 179.647 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.625 ' CB ' ' CG ' ' A' ' 77' ' ' GLU . 3.0 p90 -162.27 160.51 26.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.281 0.562 . . . . 0.0 111.703 -179.491 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.943 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 43.9 t-20 -133.92 28.93 3.82 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 122.851 1.31 . . . . 0.0 107.696 177.501 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.55 ' O ' ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -6.14 130.3 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 111.616 -2.538 . . . . 0.0 112.551 -179.856 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 1.015 HG21 ' CG1' ' A' ' 25' ' ' ILE . 3.5 m -139.78 47.8 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.311 179.696 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.624 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 90.1 m -15.89 118.13 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.285 -179.016 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.957 HG12 ' CD1' ' A' ' 18' ' ' PHE . 3.0 m -120.28 -160.46 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.8 0 CA-C-O 121.726 0.774 . . . . 0.0 111.913 -179.867 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.629 ' HG3' ' CE2' ' A' ' 17' ' ' PHE . 29.0 mtp -13.04 131.61 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 113.874 -1.512 . . . . 0.0 112.854 -178.955 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 40.03 24.78 0.06 OUTLIER Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 115.458 -0.792 . . . . 0.0 113.214 179.059 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.536 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 84.91 36.98 10.58 Favored Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.872 179.724 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.725 ' HB2' ' CG2' ' A' ' 70' ' ' VAL . 1.2 m-30 -74.59 122.14 22.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.931 0.395 . . . . 0.0 110.822 179.923 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.18 109.62 22.28 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.784 -179.483 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.233 HG21 ' CG2' ' A' ' 25' ' ' ILE . 34.8 m -98.87 11.76 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.229 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.53 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.705 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER 25.27 42.32 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 -176.968 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.943 ' HB3' ' HB3' ' A' ' 66' ' ' ASN . 51.6 t30 -1.3 67.75 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 113.185 -1.825 . . . . 0.0 109.083 -174.466 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 1.005 ' N ' HD12 ' A' ' 26' ' ' LEU . 39.1 m170 -37.36 121.09 0.82 Allowed 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 112.928 -1.942 . . . . 0.0 113.781 -176.921 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.749 ' OG1' ' HB3' ' A' ' 64' ' ' SER . 2.2 p -104.47 -32.2 9.11 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 113.448 -1.706 . . . . 0.0 109.21 178.203 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.81 ' C ' ' HG3' ' A' ' 63' ' ' LYS . . . -143.15 136.06 27.83 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 177.795 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 1.2 m -124.25 134.74 53.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.902 0.382 . . . . 0.0 110.852 179.973 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.822 ' NE2' HG13 ' A' ' 61' ' ' VAL . 2.0 p80 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.384 -179.468 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.713 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 9.2 t . . . . . 0 CA--C 1.509 -0.618 0 CA-C-O 121.185 0.517 . . . . 0.0 110.821 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.929 HD23 HD13 ' A' ' 26' ' ' LEU . 2.4 mp -95.41 138.12 33.54 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.668 179.354 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.73 ' O ' ' O ' ' A' ' 14' ' ' GLU . 3.7 pt20 -123.0 69.23 0.99 Allowed 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 122.134 0.969 . . . . 0.0 111.749 178.831 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.73 ' O ' ' O ' ' A' ' 13' ' ' GLN . 28.0 tt0 14.78 123.57 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 112.704 -2.044 . . . . 0.0 112.255 179.998 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.934 HD22 HG11 ' A' ' 76' ' ' VAL . 33.2 t-20 -48.05 107.26 0.71 Allowed Pre-proline 0 C--N 1.306 -1.31 0 CA-C-N 113.527 -1.67 . . . . 0.0 112.072 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.732 ' HD2' ' CE1' ' A' ' 17' ' ' PHE . 72.8 Cg_endo -73.81 16.37 0.52 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.407 2.072 . . . . 0.0 112.958 179.7 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.732 ' CE1' ' HD2' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -126.24 -57.54 1.39 Allowed 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 121.787 0.804 . . . . 0.0 110.205 178.832 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.966 ' CD2' HG13 ' A' ' 70' ' ' VAL . 2.7 t80 -71.92 -19.19 61.96 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.219 -179.088 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.597 ' HB3' ' O ' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -48.76 87.61 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.546 -179.983 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.559 ' O ' ' N ' ' A' ' 22' ' ' GLY . 10.2 mm-40 -112.3 166.3 11.25 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.941 -179.65 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -61.85 60.83 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.752 2.301 . . . . 0.0 111.329 179.337 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.559 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 155.45 -14.24 0.45 Allowed Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.635 -179.611 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.452 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -142.97 108.87 5.44 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-O 121.784 0.802 . . . . 0.0 111.678 -179.492 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.634 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.8 Cg_endo -103.97 60.39 0.02 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.428 0 C-N-CA 124.613 3.542 . . . . 0.0 113.199 -178.556 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.31 ' CG2' HG21 ' A' ' 76' ' ' VAL . 31.6 mm -43.48 -174.07 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 CA-C-N 115.327 -0.852 . . . . 0.0 112.566 179.194 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.941 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -145.23 -168.27 2.9 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -175.011 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 172.4 96.01 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 111.482 -2.599 . . . . 0.0 109.99 179.2 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.713 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -40.51 112.49 0.29 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.83 -178.924 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.549 ' HB2' ' HG2' ' A' ' 13' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.227 0 C-N-CA 120.463 -0.495 . . . . 0.0 111.946 -179.874 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.857 ' O ' HG12 ' A' ' 61' ' ' VAL . 2.6 t . . . . . 0 C--O 1.23 0.065 0 CA-C-O 120.832 0.349 . . . . 0.0 110.377 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.702 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . -6.11 105.75 0.01 OUTLIER 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 122.065 0.936 . . . . 0.0 112.415 -179.916 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.792 ' HG3' ' CB ' ' A' ' 81' ' ' ALA . 0.1 OUTLIER -50.51 -43.53 55.77 Favored 'General case' 0 CA--C 1.495 -1.142 0 CA-C-N 113.733 -1.576 . . . . 0.0 108.397 177.802 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.607 ' CB ' ' OG1' ' A' ' 80' ' ' THR . 43.7 m -133.11 135.51 45.29 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 113.637 -1.619 . . . . 0.0 109.48 179.906 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.817 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -125.71 163.02 23.73 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.604 0.716 . . . . 0.0 112.436 -177.88 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.794 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -132.12 30.18 4.27 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 122.704 1.24 . . . . 0.0 107.9 177.388 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.54 ' CG ' ' HA ' ' A' ' 77' ' ' GLU . 0.2 OUTLIER -8.69 128.15 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 112.075 -2.329 . . . . 0.0 112.148 -179.786 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 1.047 HG21 HG13 ' A' ' 25' ' ' ILE . 4.6 m -134.84 49.52 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.454 179.915 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.661 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 55.2 m -23.2 118.62 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.196 -179.173 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.966 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -111.65 -167.39 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.726 0.774 . . . . 0.0 112.366 -179.603 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.521 ' C ' ' O ' ' A' ' 70' ' ' VAL . 1.2 mmm 16.62 -131.7 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.14 -1.391 . . . . 0.0 112.191 -179.937 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.81 -4.06 1.97 Allowed Glycine 0 N--CA 1.445 -0.74 0 CA-C-N 115.447 -0.797 . . . . 0.0 113.287 -179.63 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.587 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 130.22 28.68 0.7 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.137 -179.766 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.661 ' O ' ' HA ' ' A' ' 69' ' ' THR . 23.0 m-85 -66.13 120.42 13.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.831 0.348 . . . . 0.0 110.943 -179.644 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.506 ' HB3' ' HD3' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -99.79 115.56 29.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.804 -179.391 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 1.31 HG21 ' CG2' ' A' ' 25' ' ' ILE . 19.0 m -104.16 11.14 8.51 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.273 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.989 178.967 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.817 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 27.39 41.5 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 -177.172 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.915 ' HB2' HG13 ' A' ' 68' ' ' VAL . 50.3 t30 -1.23 68.09 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 113.729 -1.578 . . . . 0.0 109.149 -174.566 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.941 ' N ' HD12 ' A' ' 26' ' ' LEU . 41.8 m170 -38.59 120.19 0.91 Allowed 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 112.57 -2.105 . . . . 0.0 113.905 -176.743 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.607 ' OG1' ' CB ' ' A' ' 64' ' ' SER . 2.2 p -105.14 -34.88 7.79 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 113.503 -1.681 . . . . 0.0 109.557 178.542 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.792 ' CB ' ' HG3' ' A' ' 63' ' ' LYS . . . -140.89 140.04 34.48 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 177.625 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 82' ' ' CYS . . . . . 0.585 ' SG ' HD11 ' A' ' 12' ' ' LEU . 0.8 OUTLIER -128.09 133.71 49.06 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.59 -0.444 . . . . 0.0 111.818 -179.071 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.555 ' HB3' ' CD ' ' A' ' 63' ' ' LYS . 8.0 p80 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.673 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.437 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.806 0.336 . . . . 0.0 111.0 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 1' ' ' ALA . 1.7 Cg_endo -79.88 157.92 24.22 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.983 2.455 . . . . 0.0 112.079 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.413 ' OD1' ' C ' ' A' ' 2' ' ' PRO . 0.1 OUTLIER -165.58 -90.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.216 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.517 HG23 ' H ' ' A' ' 6' ' ' ASP . 34.9 m -119.85 -168.42 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.155 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -119.12 22.49 11.83 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.253 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.517 ' H ' HG23 ' A' ' 4' ' ' VAL . 4.5 m-20 60.37 -143.35 0.52 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.782 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.437 ' O ' ' O ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -139.71 95.34 8.86 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-O 120.832 0.349 . . . . 0.0 110.973 -179.888 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.515 ' O ' ' O ' ' A' ' 31' ' ' CYS . 46.5 Cg_exo -56.26 -135.27 0.0 OUTLIER 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.879 2.386 . . . . 0.0 112.298 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.596 ' HA ' ' O ' ' A' ' 31' ' ' CYS . 29.6 tt0 -122.46 157.53 31.76 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.838 0.352 . . . . 0.0 110.819 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.556 ' SG ' ' HA2' ' A' ' 30' ' ' GLY . 27.4 t -60.95 101.28 0.14 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.007 0.432 . . . . 0.0 111.074 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.754 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 7.1 t -126.29 -148.49 0.39 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.062 179.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.054 HD23 HD13 ' A' ' 26' ' ' LEU . 5.8 mp -111.25 134.72 52.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.753 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.752 ' HG3' ' HA ' ' A' ' 29' ' ' MET . 0.5 OUTLIER -98.26 51.29 1.02 Allowed 'General case' 0 CA--C 1.502 -0.868 0 CA-C-O 121.389 0.614 . . . . 0.0 111.766 -179.385 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.677 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 38.8 tt0 0.33 117.85 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 114.118 -1.401 . . . . 0.0 111.187 -179.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.978 ' ND2' HG11 ' A' ' 76' ' ' VAL . 6.7 t-20 -46.87 115.14 3.17 Favored Pre-proline 0 C--N 1.305 -1.367 0 CA-C-N 114.186 -1.37 . . . . 0.0 112.188 -179.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -80.35 16.44 1.54 Allowed 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.822 2.348 . . . . 0.0 111.262 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.41 ' CD1' ' C ' ' A' ' 17' ' ' PHE . 9.1 t80 -125.04 -55.06 1.6 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.886 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.962 ' CD2' HG13 ' A' ' 70' ' ' VAL . 0.4 OUTLIER -73.71 -16.17 61.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.588 179.966 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.603 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 17.1 p -52.98 79.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.524 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.598 ' N ' ' O ' ' A' ' 18' ' ' PHE . 3.3 pt20 -104.03 167.61 9.79 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.145 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -61.17 63.08 0.1 OUTLIER 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.682 2.255 . . . . 0.0 111.683 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.553 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 147.91 -8.65 1.12 Allowed Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.391 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.537 ' HB3' ' HG2' ' A' ' 20' ' ' GLN . . . -147.68 102.95 3.68 Favored Pre-proline 0 CA--C 1.513 -0.442 0 CA-C-O 122.071 0.939 . . . . 0.0 111.996 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.603 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 90.7 Cg_endo -104.14 65.32 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.51 0 C-N-CA 124.923 3.749 . . . . 0.0 112.795 -178.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.29 ' CG2' HG21 ' A' ' 76' ' ' VAL . 34.3 mm -42.23 -177.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.083 0 CA-C-N 115.198 -0.91 . . . . 0.0 113.444 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.054 HD13 HD23 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -148.23 -155.77 0.66 Allowed 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -174.719 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.523 ' CG ' ' O ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER 159.93 67.17 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 113.143 -1.844 . . . . 0.0 111.478 179.569 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.754 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.1 OUTLIER 4.8 118.33 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 114.992 -1.004 . . . . 0.0 113.425 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.752 ' HA ' ' HG3' ' A' ' 13' ' ' GLN . 3.9 ttt -58.92 -85.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.481 178.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.556 ' HA2' ' SG ' ' A' ' 10' ' ' CYS . . . 120.7 82.9 0.72 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.439 -0.886 . . . . 0.0 113.243 179.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.596 ' O ' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -168.83 47.62 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.835 0.35 . . . . 0.0 110.942 179.406 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.514 ' HA ' ' HG3' ' A' ' 9' ' ' GLU . 0.8 OUTLIER -73.54 55.04 0.48 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.886 179.87 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.624 ' CD1' ' N ' ' A' ' 33' ' ' PHE . 0.1 OUTLIER 50.26 -166.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.706 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 m -140.93 57.36 1.56 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.914 0.388 . . . . 0.0 110.832 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -65.69 142.19 58.11 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.86 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -128.24 83.2 2.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.187 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.675 ' CB ' ' HD3' ' A' ' 38' ' ' PRO . 11.6 m-85 -58.38 -72.87 0.22 Allowed Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.032 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.675 ' HD3' ' CB ' ' A' ' 37' ' ' TYR . 44.5 Cg_endo -86.61 -159.33 0.09 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.735 2.29 . . . . 0.0 111.503 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.425 ' HA ' ' HD2' ' A' ' 40' ' ' PRO . 23.2 m -78.56 117.74 68.23 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.425 ' HD2' ' HA ' ' A' ' 39' ' ' THR . 5.3 Cg_endo -48.43 125.36 12.16 Favored 'Trans proline' 0 N--CA 1.465 -0.196 0 C-N-CA 122.867 2.378 . . . . 0.0 112.393 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 39' ' ' THR . 0.0 OUTLIER -112.38 168.05 9.95 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.834 -179.902 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.533 ' O ' ' CB ' ' A' ' 43' ' ' SER . 0.0 OUTLIER -147.39 -166.61 2.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.416 -179.754 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 42' ' ' ARG . 8.0 t 87.36 79.97 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.776 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.425 ' O ' ' HB3' ' A' ' 45' ' ' LYS . 18.4 tptt -160.07 38.36 0.18 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.809 -179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.558 ' O ' ' HG3' ' A' ' 47' ' ' MET . 0.3 OUTLIER 78.82 -78.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.806 -179.93 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.594 HG23 HD23 ' A' ' 48' ' ' LEU . 37.3 m 20.48 -91.81 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.525 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.558 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 2.1 mtt 53.49 46.52 25.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.997 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.594 HD23 HG23 ' A' ' 46' ' ' THR . 0.3 OUTLIER -104.65 160.92 14.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.874 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.453 ' C ' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -35.16 107.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.523 179.668 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -69.68 56.82 0.13 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.321 -179.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -113.26 68.88 0.69 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.673 179.77 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.41 ' HB2' ' O ' ' A' ' 51' ' ' LYS . 76.6 m-20 66.32 39.55 4.02 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.678 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.414 ' HB ' HD11 ' A' ' 48' ' ' LEU . 2.1 t -141.63 25.11 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.049 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -124.47 -33.09 3.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.313 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.478 ' O ' ' O ' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -65.47 -53.82 37.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.347 -179.688 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.478 ' O ' ' O ' ' A' ' 55' ' ' SER . 0.3 OUTLIER -32.64 153.8 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.205 -179.855 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.581 ' OG ' ' N ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -135.53 -165.76 1.74 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.689 179.817 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.614 HG22 ' HA ' ' A' ' 85' ' ' SER . 1.9 p 55.87 175.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.964 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 10.1 m -155.08 138.06 15.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.004 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.593 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 0.1 OUTLIER -113.73 120.63 41.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.034 0.445 . . . . 0.0 111.211 -179.886 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.605 ' O ' ' C ' ' A' ' 62' ' ' ALA . 23.8 t -130.25 72.63 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.165 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.717 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 17.96 95.13 0.0 OUTLIER 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.889 -178.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.899 ' N ' ' O ' ' A' ' 81' ' ' ALA . 21.7 tttm -50.3 -32.84 18.04 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-O 121.648 0.737 . . . . 0.0 109.198 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.642 ' O ' ' N ' ' A' ' 80' ' ' THR . 12.7 m -147.37 105.14 3.71 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.039 179.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.817 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 2.9 p90 -91.04 164.63 13.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.486 0.66 . . . . 0.0 112.072 -179.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.707 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 3.5 t-20 -135.71 28.95 3.24 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 122.927 1.346 . . . . 0.0 107.823 177.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.516 ' CG ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -9.86 131.95 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 111.637 -2.529 . . . . 0.0 112.559 -179.48 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 1.058 HG21 ' CG1' ' A' ' 25' ' ' ILE . 14.0 m -139.36 52.24 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.323 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.686 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 50.7 m -24.62 118.3 0.05 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.564 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.962 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -115.92 -168.93 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.499 0.666 . . . . 0.0 112.316 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.568 ' SD ' ' CD2' ' A' ' 74' ' ' PHE . 1.1 mtp 30.44 -137.56 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.711 -1.131 . . . . 0.0 111.034 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -71.55 14.78 1.76 Allowed Glycine 0 N--CA 1.443 -0.833 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.624 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.552 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 123.92 36.78 0.61 Allowed Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.959 -0.639 . . . . 0.0 111.881 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.686 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.7 m-85 -75.16 118.3 17.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.961 0.41 . . . . 0.0 111.096 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.471 ' HB3' ' HD3' ' A' ' 67' ' ' ARG . 0.1 OUTLIER -98.71 124.12 43.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.478 0.656 . . . . 0.0 111.393 -179.526 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.29 HG21 ' CG2' ' A' ' 25' ' ' ILE . 27.1 m -117.69 11.67 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.308 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.201 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.817 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.4 OUTLIER 25.81 40.54 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 -177.124 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.73 ' N ' ' O ' ' A' ' 76' ' ' VAL . 33.6 t30 -2.97 69.53 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 113.528 -1.669 . . . . 0.0 109.26 -174.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.996 ' N ' HD12 ' A' ' 26' ' ' LEU . 40.5 m170 -39.54 120.02 1.03 Allowed 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 113.068 -1.878 . . . . 0.0 113.266 -177.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.642 ' N ' ' O ' ' A' ' 64' ' ' SER . 0.6 OUTLIER -112.52 -5.65 14.02 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 113.425 -1.716 . . . . 0.0 110.325 179.606 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.899 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -171.38 83.9 0.08 Allowed 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.278 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.57 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 1.2 m -80.52 127.99 33.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.73 0.3 . . . . 0.0 110.943 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.593 ' O ' ' HA ' ' A' ' 60' ' ' CYS . 5.1 p80 -125.76 108.62 11.68 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.322 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.553 ' O ' ' CB ' ' A' ' 85' ' ' SER . 29.3 p -86.7 104.81 16.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.934 0.397 . . . . 0.0 110.602 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.614 ' HA ' HG22 ' A' ' 58' ' ' THR . 14.4 t 153.54 -160.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.144 -179.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.574 ' N ' ' OG ' ' A' ' 85' ' ' SER . 0.2 OUTLIER 34.26 56.19 0.64 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.974 0.416 . . . . 0.0 110.482 179.901 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 3.0 t -80.63 16.31 1.42 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.369 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -174.43 -166.55 0.27 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.843 0.354 . . . . 0.0 110.88 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -126.08 151.04 47.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.017 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.477 ' O ' ' N ' ' A' ' 92' ' ' SER . 0.0 OUTLIER -110.99 -173.94 2.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.42 179.568 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.602 ' O ' ' C ' ' A' ' 92' ' ' SER . 1.0 OUTLIER 51.75 -89.04 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.505 -179.668 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.602 ' C ' ' O ' ' A' ' 91' ' ' LYS . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.294 -0.86 . . . . 0.0 111.728 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 0.996 ' H82' HD11 ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . 0.77 ' H3 ' ' H2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.652 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . 0.652 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . 0.77 ' H2 ' ' H3 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.844 0.354 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -47.38 166.33 0.1 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.274 0 C-N-CA 122.804 2.336 . . . . 0.0 112.447 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -101.89 178.04 4.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.696 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 70.9 t -77.6 144.81 10.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.238 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -95.01 -170.09 2.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.851 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -91.09 152.57 20.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.986 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.561 ' CB ' ' HD2' ' A' ' 8' ' ' PRO . 0.4 OUTLIER -177.47 176.23 0.51 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.754 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.561 ' HD2' ' CB ' ' A' ' 7' ' ' CYS . 83.0 Cg_exo -35.72 140.13 0.13 Allowed 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.847 2.365 . . . . 0.0 112.619 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.553 ' O ' HG22 ' A' ' 11' ' ' THR . 5.2 tt0 -48.87 106.89 0.11 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.978 -179.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.526 ' CB ' ' N ' ' A' ' 32' ' ' CYS . 0.3 OUTLIER -44.09 127.32 5.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.226 -179.868 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.706 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 10.0 t 177.47 -170.63 0.09 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.495 179.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.912 HD23 HD13 ' A' ' 26' ' ' LEU . 6.5 mp -81.22 135.37 35.74 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.0 -179.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.652 ' O ' ' O ' ' A' ' 14' ' ' GLU . 54.6 mt-30 -118.33 57.53 0.85 Allowed 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.365 179.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.652 ' O ' ' O ' ' A' ' 13' ' ' GLN . 6.1 tt0 7.69 119.87 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.813 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.931 ' ND2' HG11 ' A' ' 76' ' ' VAL . 3.5 t-20 -39.22 128.03 1.3 Allowed Pre-proline 0 C--N 1.309 -1.167 0 CA-C-N 114.337 -1.302 . . . . 0.0 111.837 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.486 ' HD2' ' OD1' ' A' ' 15' ' ' ASN . 94.2 Cg_endo -85.22 31.95 0.48 Allowed 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.65 2.233 . . . . 0.0 111.167 178.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.521 ' CE2' ' HG3' ' A' ' 71' ' ' MET . 22.4 t80 -148.41 -55.75 0.21 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.634 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.869 ' CE2' HG13 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -70.76 -26.0 63.16 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.825 -1.079 . . . . 0.0 110.834 -179.51 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.675 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 35.9 t -50.92 81.09 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.944 -179.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.584 ' N ' ' O ' ' A' ' 18' ' ' PHE . 3.9 mm-40 -122.55 159.01 54.75 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.068 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -51.02 77.52 0.02 OUTLIER 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.748 2.299 . . . . 0.0 111.876 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 138.61 -18.63 3.21 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.601 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.565 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -147.11 102.76 3.82 Favored Pre-proline 0 CA--C 1.513 -0.475 0 CA-C-O 121.871 0.843 . . . . 0.0 111.782 -179.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.675 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 93.5 Cg_endo -105.89 64.49 0.02 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.564 0 C-N-CA 124.671 3.58 . . . . 0.0 113.603 -178.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.233 ' CG2' HG21 ' A' ' 76' ' ' VAL . 24.5 mm -43.4 -174.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.051 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.691 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.143 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -151.37 -161.67 1.38 Allowed 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 114.49 1.292 . . . . 0.0 114.49 -175.418 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.493 ' CB ' ' O ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER 159.72 83.51 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 112.809 -1.996 . . . . 0.0 110.9 179.104 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.706 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.0 OUTLIER -27.57 110.5 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.004 -179.405 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.589 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.7 mmt -127.59 107.11 9.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.902 0.382 . . . . 0.0 111.161 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.471 ' HA3' ' HA ' ' A' ' 10' ' ' CYS . . . 161.62 -158.88 30.76 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.999 -0.619 . . . . 0.0 112.385 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.415 ' SG ' ' C ' ' A' ' 30' ' ' GLY . 1.8 m -155.23 101.38 2.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.649 0.261 . . . . 0.0 110.871 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.526 ' N ' ' CB ' ' A' ' 10' ' ' CYS . 0.8 OUTLIER -54.12 169.54 0.17 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.571 179.939 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.527 ' CD1' ' N ' ' A' ' 33' ' ' PHE . 0.5 OUTLIER -160.15 160.87 33.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.087 -179.912 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 m -53.89 -30.46 46.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.142 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.5 mtp85 67.4 98.77 0.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.272 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -179.6 25.68 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.484 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.577 ' N ' ' CD ' ' A' ' 38' ' ' PRO . 0.3 OUTLIER -130.43 43.76 1.2 Allowed Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 120.813 0.339 . . . . 0.0 111.264 -179.845 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 37' ' ' TYR . 57.1 Cg_endo -71.1 -166.6 0.24 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.672 2.248 . . . . 0.0 112.23 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.3 t -104.36 83.8 0.8 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.321 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.95 -160.63 0.04 OUTLIER 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.739 2.293 . . . . 0.0 112.11 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.669 ' O ' ' CB ' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -76.47 -3.21 36.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.953 -179.927 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.669 ' CB ' ' O ' ' A' ' 41' ' ' LEU . 4.8 tmm_? 135.0 -50.8 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.314 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 55.0 m -45.93 115.01 0.88 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.11 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -115.89 163.98 15.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.408 179.602 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.48 48.83 19.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.967 0.413 . . . . 0.0 110.606 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.529 ' O ' ' CB ' ' A' ' 47' ' ' MET . 11.2 m -166.77 136.42 3.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.759 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.529 ' CB ' ' O ' ' A' ' 46' ' ' THR . 4.7 mtt 157.97 61.33 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.809 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.457 ' O ' ' O ' ' A' ' 47' ' ' MET . 4.4 tp 55.92 154.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.993 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.45 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -78.77 -163.06 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.108 179.951 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.443 ' H ' HG12 ' A' ' 49' ' ' VAL . 5.8 mt-30 53.5 42.27 31.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.133 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.436 ' HD2' ' HA ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -118.6 50.99 1.13 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.815 0.34 . . . . 0.0 111.187 -179.946 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.457 ' O ' ' C ' ' A' ' 53' ' ' VAL . 28.3 t-20 -152.1 50.75 0.79 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.034 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.457 ' C ' ' O ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -33.41 147.31 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.782 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 55' ' ' SER . 6.6 m -149.31 131.18 15.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.889 0.376 . . . . 0.0 111.176 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.493 ' O ' ' HB3' ' A' ' 56' ' ' GLU . 8.4 t 176.95 -36.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.709 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.493 ' HB3' ' O ' ' A' ' 55' ' ' SER . 0.0 OUTLIER 170.56 124.82 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.837 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.86 172.85 0.23 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.901 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.445 HG22 ' C ' ' A' ' 84' ' ' CYS . 0.0 OUTLIER -112.3 158.46 19.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.197 -179.797 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.583 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 0.5 OUTLIER -163.11 123.58 2.31 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.888 179.758 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.662 ' O ' ' HB ' ' A' ' 61' ' ' VAL . 1.7 m -55.3 -177.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.805 -179.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.662 ' HB ' ' O ' ' A' ' 60' ' ' CYS . 9.6 p 148.28 62.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.604 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.588 ' HA ' ' HA ' ' A' ' 82' ' ' CYS . . . 10.28 110.02 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.511 -179.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.884 ' N ' ' O ' ' A' ' 81' ' ' ALA . 8.2 ttmt -57.01 -42.96 81.3 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.611 0.72 . . . . 0.0 109.088 178.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.523 ' O ' ' N ' ' A' ' 80' ' ' THR . 16.9 m -141.03 128.75 21.57 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.523 -1.217 . . . . 0.0 109.095 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.748 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 4.8 p90 -114.73 157.52 23.07 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -178.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.945 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -125.3 27.97 6.45 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 122.615 1.198 . . . . 0.0 108.219 176.645 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.7 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 4.2 ptp180 -8.35 103.72 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 112.36 -2.2 . . . . 0.0 111.966 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 1.018 HG21 HG13 ' A' ' 25' ' ' ILE . 3.4 m -104.02 45.93 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.393 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.675 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 28.5 m -16.33 119.05 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.63 -178.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.869 HG13 ' CE2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -113.49 -162.8 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.691 179.94 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.521 ' HG3' ' CE2' ' A' ' 17' ' ' PHE . 6.0 mtp -29.13 151.58 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.208 -1.36 . . . . 0.0 111.907 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 43.7 23.87 0.39 Allowed Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.645 -0.788 . . . . 0.0 111.966 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.463 ' C ' HG23 ' A' ' 69' ' ' THR . . . 73.77 28.84 64.25 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.163 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.708 ' CB ' HG23 ' A' ' 70' ' ' VAL . 20.3 m-85 -43.81 170.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.65 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 22.3 mtmt -153.72 93.26 1.65 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.859 0.361 . . . . 0.0 111.318 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.233 HG21 ' CG2' ' A' ' 25' ' ' ILE . 18.6 m -93.0 15.73 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.489 -1.391 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.764 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.748 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 23.42 43.72 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 -177.691 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.945 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 12.9 t-20 1.55 75.52 0.0 OUTLIER 'General case' 0 CA--C 1.499 -1.005 0 CA-C-N 114.519 -1.219 . . . . 0.0 108.043 -175.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 1.143 ' N ' HD12 ' A' ' 26' ' ' LEU . 33.6 m170 -49.19 99.58 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.419 0 CA-C-O 122.61 1.195 . . . . 0.0 111.669 -176.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.711 HG23 ' O ' ' A' ' 78' ' ' ASN . 2.8 p -92.07 -3.5 55.66 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.55 -1.659 . . . . 0.0 109.71 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.884 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -174.33 126.75 0.34 Allowed 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.5 OUTLIER -121.47 127.91 51.56 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.987 0.422 . . . . 0.0 111.281 -179.21 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.415 ' O ' ' CD2' ' A' ' 83' ' ' HIS . 0.3 OUTLIER -140.77 137.52 33.44 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.788 -179.858 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.583 ' HA ' ' O ' ' A' ' 59' ' ' CYS . 78.2 m -91.85 137.04 32.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.851 0.358 . . . . 0.0 110.96 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.456 ' N ' ' H ' ' A' ' 59' ' ' CYS . 6.7 p -148.74 -151.88 0.41 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.834 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.51 ' HB ' ' CE1' ' A' ' 89' ' ' TYR . 5.3 m -91.06 23.71 3.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.848 0.356 . . . . 0.0 110.994 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.479 ' O ' ' O ' ' A' ' 88' ' ' TYR . 33.7 m 58.74 82.08 0.15 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.356 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.479 ' O ' ' O ' ' A' ' 87' ' ' CYS . 0.8 OUTLIER 28.96 97.21 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.479 179.439 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.51 ' CE1' ' HB ' ' A' ' 86' ' ' THR . 13.0 m-85 -52.2 -58.14 7.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.791 179.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.476 ' O ' ' O ' ' A' ' 89' ' ' TYR . 0.4 OUTLIER 39.78 -167.41 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.94 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.502 ' CG ' ' O ' ' A' ' 91' ' ' LYS . 12.8 tttm -114.25 58.68 0.69 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.946 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.0 p . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.966 180.0 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 0.731 ' H82' HD11 ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . 0.473 ' H2 ' ' O5 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . 0.473 ' O5 ' ' H2 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . 0.442 ' H2 ' ' H61' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . 0.537 ' O3 ' ' O5 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.514 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . 0.514 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . 0.537 ' O5 ' ' O3 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.586 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.484 1.268 0 CA-C-O 120.69 0.281 . . . . 0.0 111.22 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.586 ' HD2' ' N ' ' A' ' 1' ' ' ALA . 35.6 Cg_endo -66.07 -170.38 0.19 Allowed 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.379 2.052 . . . . 0.0 112.296 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.4 ' O ' ' OD1' ' A' ' 3' ' ' ASP . 0.7 OUTLIER -102.55 148.62 25.31 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.922 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -139.05 19.45 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.891 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.463 ' O ' ' HB2' ' A' ' 6' ' ' ASP . 1.2 mt-30 -155.26 -165.38 1.99 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.731 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.463 ' HB2' ' O ' ' A' ' 5' ' ' GLN . 0.5 OUTLIER 71.6 136.9 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.591 -179.81 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -45.26 161.82 0.23 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.736 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -82.31 23.38 0.79 Allowed 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.868 2.379 . . . . 0.0 112.56 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 71.97 148.96 0.09 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.955 0.407 . . . . 0.0 110.941 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.501 ' N ' ' O ' ' A' ' 31' ' ' CYS . 3.4 t -85.33 130.15 34.66 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.681 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.709 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 4.8 t -177.94 -171.32 0.28 Allowed 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.159 0.504 . . . . 0.0 111.021 179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.864 HD23 HD13 ' A' ' 26' ' ' LEU . 8.2 mp -75.28 126.34 30.81 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.925 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.586 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.9 mt-30 -104.16 52.81 0.75 Allowed 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.948 179.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.645 ' HG3' ' HB2' ' A' ' 24' ' ' PRO . 2.1 tt0 -1.16 121.87 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.159 -1.837 . . . . 0.0 111.401 -178.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.735 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.4 OUTLIER -58.68 102.06 0.28 Allowed Pre-proline 0 C--N 1.307 -1.247 0 CA-C-N 114.348 -1.296 . . . . 0.0 112.565 -179.101 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.522 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 2.8 Cg_exo -73.45 2.37 5.8 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.267 1.978 . . . . 0.0 109.084 177.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.527 ' CE1' ' SD ' ' A' ' 71' ' ' MET . 2.1 t80 -93.3 -60.69 1.73 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 113.557 -1.656 . . . . 0.0 110.287 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.866 ' CD1' HG21 ' A' ' 70' ' ' VAL . 12.6 m-85 -81.35 -5.79 58.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.044 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.512 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -52.81 89.15 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.51 179.72 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.553 ' CB ' ' CD ' ' A' ' 21' ' ' PRO . 5.3 pt20 -96.55 -176.38 0.53 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.818 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.553 ' CD ' ' CB ' ' A' ' 20' ' ' GLN . 2.9 Cg_endo -73.86 60.63 4.51 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.522 2.148 . . . . 0.0 111.402 179.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 143.12 3.35 0.9 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.661 -0.78 . . . . 0.0 113.263 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.952 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -154.56 105.82 2.36 Favored Pre-proline 0 CA--C 1.514 -0.405 0 CA-C-O 121.894 0.854 . . . . 0.0 111.808 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.661 ' O ' ' O ' ' A' ' 25' ' ' ILE . 66.6 Cg_endo -103.4 73.08 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.392 0 C-N-CA 124.77 3.647 . . . . 0.0 113.004 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.162 ' CG2' HG21 ' A' ' 76' ' ' VAL . 6.7 mm -38.52 -177.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.885 ' N ' HG22 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -151.21 -163.66 1.82 Allowed 'General case' 0 CA--C 1.499 -1.013 0 CA-C-O 122.851 1.31 . . . . 0.0 114.262 -175.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.558 ' CG ' ' O ' ' A' ' 27' ' ' GLN . 0.3 OUTLIER 166.27 66.49 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 112.363 -2.198 . . . . 0.0 110.836 179.331 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.709 ' HA ' ' O ' ' A' ' 11' ' ' THR . 3.9 t -24.73 109.26 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.223 -179.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.52 ' HG2' ' OE1' ' A' ' 13' ' ' GLN . 3.4 ttm -147.46 125.91 12.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.078 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 169.29 -135.65 3.69 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.854 -0.688 . . . . 0.0 112.158 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.501 ' O ' ' N ' ' A' ' 10' ' ' CYS . 2.8 m -146.69 140.15 25.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.724 0.297 . . . . 0.0 110.675 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.7 p -106.76 138.38 43.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.934 0.397 . . . . 0.0 111.259 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.561 ' CD1' ' N ' ' A' ' 34' ' ' SER . 4.4 p90 -161.81 -31.87 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.688 179.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.561 ' N ' ' CD1' ' A' ' 33' ' ' PHE . 3.4 m -61.5 137.44 58.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.487 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.697 ' O ' ' HB2' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 66.49 111.66 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.782 -179.808 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.697 ' HB2' ' O ' ' A' ' 35' ' ' ARG . . . 159.64 97.41 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.383 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.438 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.5 OUTLIER -45.85 155.11 0.52 Allowed Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.191 179.608 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.438 ' C ' ' O ' ' A' ' 37' ' ' TYR . 66.8 Cg_exo -29.74 143.52 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 123.023 2.482 . . . . 0.0 112.295 179.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.9 t -112.71 130.9 23.0 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.054 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -69.76 149.79 67.37 Favored 'Trans proline' 0 C--O 1.231 0.133 0 C-N-CA 122.981 2.454 . . . . 0.0 112.391 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.622 HD23 ' HB2' ' A' ' 42' ' ' ARG . 2.3 tt -95.15 -9.38 33.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.688 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.622 ' HB2' HD23 ' A' ' 41' ' ' LEU . 5.8 mtp180 166.82 133.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.127 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 30.0 m -153.89 19.83 0.52 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.612 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.26 166.04 13.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.826 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -166.86 -164.52 0.64 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.002 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -97.96 38.34 1.32 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.024 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.7 ttp -130.88 -81.61 0.53 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.917 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.523 ' HB3' ' CE ' ' A' ' 51' ' ' LYS . 0.2 OUTLIER -89.04 110.54 21.23 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.817 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.463 ' O ' ' O ' ' A' ' 48' ' ' LEU . 2.4 m -44.17 174.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.378 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.543 ' CG ' ' HB ' ' A' ' 53' ' ' VAL . 0.1 OUTLIER -33.84 118.45 0.36 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.397 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.525 ' O ' ' CB ' ' A' ' 52' ' ' ASN . 18.0 ptpt -122.73 74.44 1.2 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.409 179.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.525 ' CB ' ' O ' ' A' ' 51' ' ' LYS . 18.5 t30 86.58 50.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.352 -179.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.543 ' HB ' ' CG ' ' A' ' 50' ' ' GLN . 2.1 p -57.34 140.61 15.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.662 -179.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.1 p -131.81 -26.21 2.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.642 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 m -74.08 58.52 0.69 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.81 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.428 ' OE2' ' OG ' ' A' ' 85' ' ' SER . 0.1 OUTLIER -100.36 134.79 42.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.505 179.747 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -46.92 93.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.907 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.422 ' N ' ' O ' ' A' ' 56' ' ' GLU . 0.5 OUTLIER -66.56 140.57 57.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.042 0.448 . . . . 0.0 111.002 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.494 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 0.5 OUTLIER -157.65 138.78 13.44 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.21 179.83 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -105.8 71.62 0.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.786 179.766 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.661 HG12 ' O ' ' A' ' 61' ' ' VAL . 40.1 t -88.49 79.33 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.979 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.692 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 16.83 112.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.634 ' N ' ' O ' ' A' ' 81' ' ' ALA . 20.2 ttmt -54.16 -33.61 58.41 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.652 ' O ' ' HB1' ' A' ' 62' ' ' ALA . 1.8 m -137.27 -175.32 4.02 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.964 178.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.69 ' HB3' ' HB3' ' A' ' 77' ' ' GLU . 1.0 OUTLIER -164.6 162.06 21.34 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.288 0.566 . . . . 0.0 111.588 -179.77 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.674 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -132.54 27.66 4.36 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.194 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.6 ' HG3' ' HA ' ' A' ' 77' ' ' GLU . 2.4 ttm105 -8.05 121.4 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 112.284 -2.235 . . . . 0.0 111.311 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 1.069 HG13 ' HB2' ' A' ' 78' ' ' ASN . 4.3 m -123.72 43.62 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.803 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.653 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 54.5 m -17.82 118.35 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.764 -178.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.866 HG21 ' CD1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -122.25 -169.79 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.485 -179.054 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.632 ' HG3' ' CG ' ' A' ' 74' ' ' PHE . 0.1 OUTLIER 41.54 -140.09 0.12 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.368 -179.59 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -70.63 0.34 27.68 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.811 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.431 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 136.11 40.94 0.13 Allowed Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.525 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.675 ' C ' ' HG2' ' A' ' 75' ' ' LYS . 2.4 m-85 -69.41 -179.33 1.62 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.675 ' HG2' ' C ' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -157.45 97.58 1.62 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.984 0.365 . . . . 0.0 111.984 -179.466 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.162 HG21 ' CG2' ' A' ' 25' ' ' ILE . 16.3 m -91.62 11.93 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.42 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.755 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 29.22 39.56 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 105.083 -2.192 . . . . 0.0 105.083 -176.601 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 1.069 ' HB2' HG13 ' A' ' 68' ' ' VAL . 32.7 t30 -0.14 65.45 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 112.816 -1.993 . . . . 0.0 108.378 -174.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.881 ' O ' HD13 ' A' ' 26' ' ' LEU . 37.8 m170 -34.46 123.58 0.52 Allowed 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 112.703 -2.044 . . . . 0.0 113.43 -176.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.492 ' OG1' ' HB3' ' A' ' 64' ' ' SER . 6.5 p -110.78 -15.14 13.88 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 113.471 -1.695 . . . . 0.0 110.426 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.634 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -161.87 147.65 13.47 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.888 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.5 OUTLIER -127.27 154.55 44.75 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.904 0.383 . . . . 0.0 111.227 -179.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.438 ' O ' ' CD2' ' A' ' 83' ' ' HIS . 0.3 OUTLIER -155.66 112.86 3.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.943 -179.931 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.705 ' O ' ' CB ' ' A' ' 85' ' ' SER . 4.1 t -88.4 123.79 33.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.122 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.705 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 36.9 t 119.12 43.05 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.155 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 66.7 p -147.55 68.32 1.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.763 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 1.8 m -156.97 83.6 0.94 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.837 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.412 ' CD1' ' C ' ' A' ' 88' ' ' TYR . 8.1 p90 -92.52 141.42 28.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.905 0.383 . . . . 0.0 111.007 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.539 ' CE2' ' CD2' ' A' ' 90' ' ' HIS . 0.2 OUTLIER -168.2 172.67 8.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.669 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.539 ' CD2' ' CE2' ' A' ' 89' ' ' TYR . 8.0 m-70 26.04 72.7 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.228 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.439 ' O ' ' HG3' ' A' ' 91' ' ' LYS . 0.0 OUTLIER -110.13 4.98 21.64 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.296 -179.653 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 85.4 p . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.297 -0.858 . . . . 0.0 110.932 -179.746 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 0.952 ' H83' ' HB1' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.56 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . 0.485 ' H3 ' ' H2 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . 0.557 ' O2 ' ' O7 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.557 ' O7 ' ' O2 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . 0.503 ' H2 ' ' O3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.771 0.319 . . . . 0.0 111.014 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.478 ' O ' ' HB3' ' A' ' 3' ' ' ASP . 45.8 Cg_exo -55.76 -164.59 0.01 OUTLIER 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.708 2.272 . . . . 0.0 112.466 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.478 ' HB3' ' O ' ' A' ' 2' ' ' PRO . 6.8 p-10 167.94 -26.83 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.687 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.534 HG22 ' HG2' ' A' ' 5' ' ' GLN . 1.5 p -32.35 119.07 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.464 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.534 ' HG2' HG22 ' A' ' 4' ' ' VAL . 7.7 pt20 23.51 60.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.508 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' ' 4' ' ' VAL . 1.0 OUTLIER -159.45 121.1 3.32 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.838 179.91 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.448 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 31.1 p -136.05 143.65 44.95 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.955 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 7' ' ' CYS . 28.4 Cg_exo -60.79 130.46 33.16 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.68 2.253 . . . . 0.0 111.968 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.428 ' C ' ' O ' ' A' ' 8' ' ' PRO . 9.7 tt0 -35.87 129.33 0.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.031 0.443 . . . . 0.0 110.949 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.474 ' HB3' ' SG ' ' A' ' 32' ' ' CYS . 42.6 t -41.07 134.76 1.96 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.349 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.689 ' O ' ' N ' ' A' ' 29' ' ' MET . 3.3 t -173.61 -169.68 0.53 Allowed 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.37 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.853 HD23 HD13 ' A' ' 26' ' ' LEU . 7.8 mp -75.74 133.66 40.68 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.274 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.713 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.7 mt-30 -120.75 65.12 0.85 Allowed 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 121.636 0.731 . . . . 0.0 110.977 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.713 ' O ' ' O ' ' A' ' 13' ' ' GLN . 18.2 tt0 2.91 127.22 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 113.566 -1.652 . . . . 0.0 111.903 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.931 ' ND2' HG11 ' A' ' 76' ' ' VAL . 1.3 t30 -56.19 108.82 1.32 Allowed Pre-proline 0 C--N 1.307 -1.28 0 CA-C-N 113.858 -1.519 . . . . 0.0 113.339 -178.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.755 ' HD2' ' CE1' ' A' ' 17' ' ' PHE . 9.9 Cg_exo -69.95 4.95 1.97 Allowed 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.508 2.139 . . . . 0.0 112.042 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.755 ' CE1' ' HD2' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -114.12 -56.16 2.42 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.394 178.674 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 1.187 ' CD2' HG13 ' A' ' 70' ' ' VAL . 0.3 OUTLIER -78.97 -5.58 54.18 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.888 -178.751 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.468 ' CB ' ' O ' ' A' ' 15' ' ' ASN . 2.2 t -64.91 95.28 0.15 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.746 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.575 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.1 OUTLIER -135.84 144.74 49.92 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.857 -179.649 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.563 ' CD ' ' HG3' ' A' ' 20' ' ' GLN . 1.3 Cg_endo -45.1 82.91 0.01 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.7 2.267 . . . . 0.0 111.343 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.575 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 138.35 -15.87 3.41 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.73 -179.088 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.444 ' O ' ' O ' ' A' ' 18' ' ' PHE . . . -153.95 100.28 2.53 Favored Pre-proline 0 CA--C 1.51 -0.587 0 CA-C-O 121.958 0.885 . . . . 0.0 111.094 179.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.662 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.1 Cg_endo -103.26 60.33 0.02 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.588 0 C-N-CA 124.643 3.562 . . . . 0.0 112.78 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.226 ' CG2' HG21 ' A' ' 76' ' ' VAL . 23.1 mm -40.25 -176.69 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.141 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.876 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.994 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -148.87 -160.16 1.13 Allowed 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -175.105 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.466 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER 161.8 98.17 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 112.376 -2.193 . . . . 0.0 109.723 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.649 ' SG ' HD12 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -48.29 103.65 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.492 -0.777 . . . . 0.0 111.711 -178.531 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.689 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.0 OUTLIER -114.6 -165.21 0.99 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.47 179.512 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.11 -145.15 17.99 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.599 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -154.82 147.06 23.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.827 0.346 . . . . 0.0 110.896 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.474 ' SG ' ' HB3' ' A' ' 10' ' ' CYS . 4.1 m -100.21 -174.79 2.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.896 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -141.76 -56.96 0.47 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.782 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.445 ' OG ' ' N ' ' A' ' 35' ' ' ARG . 24.4 p -166.6 -132.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.594 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.445 ' N ' ' OG ' ' A' ' 34' ' ' SER . 4.4 ttt180 -166.12 100.88 0.64 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.842 0.353 . . . . 0.0 110.957 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.485 ' O ' ' C ' ' A' ' 37' ' ' TYR . . . 56.24 158.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.453 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.485 ' C ' ' O ' ' A' ' 36' ' ' ALA . 3.0 m-30 28.58 74.76 0.38 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.238 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.437 ' O ' ' O ' ' A' ' 39' ' ' THR . 30.6 Cg_endo -65.07 -3.77 7.79 Favored 'Trans proline' 0 CA--C 1.515 -0.433 0 C-N-CA 122.826 2.35 . . . . 0.0 112.513 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.437 ' O ' ' O ' ' A' ' 38' ' ' PRO . 69.0 p 45.63 100.5 0.03 OUTLIER Pre-proline 0 C--N 1.313 -1.003 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.702 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.492 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 36.2 Cg_exo -61.36 -165.23 0.04 OUTLIER 'Trans proline' 0 C--O 1.231 0.131 0 C-N-CA 122.854 2.369 . . . . 0.0 111.78 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.492 ' HB2' ' O ' ' A' ' 40' ' ' PRO . 26.1 mt 66.56 142.8 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.888 0.375 . . . . 0.0 110.899 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -118.45 68.91 0.79 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.817 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 88.4 p -108.86 49.49 0.81 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.067 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.88 98.24 6.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.643 179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.42 92.59 7.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.168 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.445 ' C ' ' CG ' ' A' ' 47' ' ' MET . 1.3 t -56.41 171.17 0.31 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.906 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.445 ' CG ' ' C ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -163.76 34.47 0.08 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.871 179.886 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.647 ' HG ' HG23 ' A' ' 49' ' ' VAL . 34.4 tp -146.37 101.31 3.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.005 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.647 HG23 ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER 53.53 116.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.108 -179.907 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -97.06 37.04 1.35 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.089 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -121.21 29.05 7.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.826 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.486 ' O ' ' O ' ' A' ' 53' ' ' VAL . 3.8 m-20 81.28 89.2 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.897 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.486 ' O ' ' O ' ' A' ' 52' ' ' ASN . 2.8 m -49.38 -171.57 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.195 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.411 ' N ' HG23 ' A' ' 53' ' ' VAL . 23.2 p -80.06 -153.47 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.918 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.9 m -112.74 111.82 22.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.868 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.46 69.63 1.2 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.941 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.9 p -149.73 -98.0 0.07 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.131 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.513 HG22 ' HB2' ' A' ' 85' ' ' SER . 1.1 p -106.68 -173.16 2.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.956 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.558 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 0.7 OUTLIER 170.44 112.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.347 179.535 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.469 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 0.1 OUTLIER -77.88 115.48 17.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.964 179.827 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.624 ' O ' ' C ' ' A' ' 62' ' ' ALA . 47.8 t -133.51 71.93 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.713 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.624 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 0.3 103.36 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.696 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.791 ' N ' ' O ' ' A' ' 81' ' ' ALA . 1.6 ttmm -54.84 -38.74 67.81 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.545 ' O ' ' N ' ' A' ' 80' ' ' THR . 15.5 m -140.94 117.0 10.52 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.779 -1.101 . . . . 0.0 109.717 178.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.752 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 2.8 p90 -107.57 161.99 14.36 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.283 -178.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.82 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 1.0 OUTLIER -129.69 28.13 5.16 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 122.357 1.075 . . . . 0.0 108.173 177.11 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.744 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -11.85 115.81 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 112.565 -2.107 . . . . 0.0 111.734 -179.899 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 1.044 HG21 HG13 ' A' ' 25' ' ' ILE . 3.8 m -120.14 48.12 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 114.867 -1.06 . . . . 0.0 110.737 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.637 ' C ' ' O ' ' A' ' 68' ' ' VAL . 5.8 m -14.05 118.84 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.079 -179.062 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 1.187 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -107.52 -162.42 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.799 0.809 . . . . 0.0 111.729 -179.8 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.539 ' O ' ' CD1' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -32.66 151.45 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.929 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 48.01 19.23 0.95 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.15 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.58 ' C ' HG23 ' A' ' 69' ' ' THR . . . 70.82 30.26 68.41 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.303 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.587 ' O ' ' HA ' ' A' ' 69' ' ' THR . 5.8 m-30 -51.67 -174.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.803 0.335 . . . . 0.0 111.007 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -158.97 121.05 3.49 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.274 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.226 HG21 ' CG2' ' A' ' 25' ' ' ILE . 19.6 m -118.18 12.08 7.11 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.494 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.437 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.752 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 28.26 39.71 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 -177.05 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.919 ' HB2' HG13 ' A' ' 68' ' ' VAL . 49.2 t30 -0.8 68.49 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.899 0 CA-C-N 113.531 -1.668 . . . . 0.0 108.55 -174.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.994 ' N ' HD12 ' A' ' 26' ' ' LEU . 39.4 m170 -39.48 118.01 0.78 Allowed 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 113.198 -1.819 . . . . 0.0 114.1 -176.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.545 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.0 OUTLIER -109.12 -17.01 13.98 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 113.379 -1.737 . . . . 0.0 109.487 178.792 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.791 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -162.88 136.93 6.19 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.263 -0.88 . . . . 0.0 108.942 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -125.9 140.98 52.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.706 0.289 . . . . 0.0 110.636 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.987 ' CE1' HG21 ' A' ' 86' ' ' THR . 0.5 OUTLIER -136.6 114.43 11.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.98 0.419 . . . . 0.0 111.502 -179.794 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.628 ' O ' ' CB ' ' A' ' 85' ' ' SER . 0.1 OUTLIER -91.08 133.58 35.21 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.478 179.587 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.628 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 4.9 t 98.22 17.11 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.993 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.987 HG21 ' CE1' ' A' ' 83' ' ' HIS . 9.1 t -96.3 33.81 1.71 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.431 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 18.2 m -84.02 60.19 5.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.194 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.415 ' O ' ' O ' ' A' ' 89' ' ' TYR . 4.1 m-30 -124.46 121.64 35.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.797 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.415 ' O ' ' O ' ' A' ' 88' ' ' TYR . 14.5 m-30 -39.09 160.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.034 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -98.73 64.44 1.48 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.124 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -110.43 98.1 7.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.716 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.216 -0.897 . . . . 0.0 111.029 -179.813 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 1.019 ' H82' HD11 ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.614 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . 0.435 ' C1 ' ' O6 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . 0.498 ' O3 ' ' C1 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . 0.498 ' C1 ' ' O3 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 121.013 0.435 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -46.8 172.47 0.03 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 123.236 2.624 . . . . 0.0 112.453 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -119.78 -53.55 2.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.984 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 34.7 m -124.17 -146.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.803 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -102.59 139.77 37.75 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.75 0.309 . . . . 0.0 111.236 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.482 ' O ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -160.65 178.95 8.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.856 179.858 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.482 ' O ' ' O ' ' A' ' 6' ' ' ASP . 0.1 OUTLIER 56.02 150.7 0.06 OUTLIER Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.607 -179.652 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.472 ' O ' ' O ' ' A' ' 31' ' ' CYS . 11.7 Cg_endo -55.17 -164.2 0.01 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.495 2.13 . . . . 0.0 111.875 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.569 ' OE1' ' CZ ' ' A' ' 33' ' ' PHE . 0.1 OUTLIER -117.87 161.76 19.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.057 0.456 . . . . 0.0 111.143 -179.892 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.499 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 47.3 t -61.63 125.27 23.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.382 -179.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.678 ' O ' HD12 ' A' ' 12' ' ' LEU . 1.0 OUTLIER -149.75 -144.11 0.15 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.521 179.492 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.846 HD23 HD13 ' A' ' 26' ' ' LEU . 6.1 mp -122.27 138.19 54.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.154 0.502 . . . . 0.0 111.093 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.63 ' O ' ' C ' ' A' ' 14' ' ' GLU . 1.6 mt-30 -96.15 44.97 1.07 Allowed 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.197 -179.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.66 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 21.8 tt0 -2.53 116.63 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 114.143 -1.389 . . . . 0.0 110.66 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.746 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.9 OUTLIER -56.03 103.1 0.34 Allowed Pre-proline 0 C--N 1.304 -1.4 0 CA-C-N 114.223 -1.353 . . . . 0.0 112.367 -178.8 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.553 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 72.6 Cg_endo -75.37 10.27 1.89 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.247 1.965 . . . . 0.0 109.887 177.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.576 ' CZ ' ' SD ' ' A' ' 71' ' ' MET . 0.8 OUTLIER -106.06 -59.55 1.76 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.212 -1.358 . . . . 0.0 110.879 -179.478 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.768 ' HD2' HG21 ' A' ' 25' ' ' ILE . 8.8 m-85 -80.34 -1.71 42.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.822 -179.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.464 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 27.4 t -48.94 93.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.841 0.353 . . . . 0.0 110.179 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.543 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.1 OUTLIER -91.43 168.38 13.56 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.921 -179.566 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.417 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 27.2 Cg_exo -62.55 59.69 0.14 Allowed 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.708 2.272 . . . . 0.0 111.462 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.543 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 138.62 5.21 1.51 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.898 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 1.009 ' CB ' ' H83' ' A' ' 178' ' ' NAG . . . -150.98 101.69 3.02 Favored Pre-proline 0 CA--C 1.511 -0.543 0 CA-C-O 122.082 0.944 . . . . 0.0 111.938 -179.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.587 ' O ' ' O ' ' A' ' 25' ' ' ILE . 18.6 Cg_endo -96.17 81.24 0.1 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.464 0 C-N-CA 124.504 3.469 . . . . 0.0 112.708 -179.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.244 ' CG2' HG21 ' A' ' 76' ' ' VAL . 12.6 mm -42.01 -175.59 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.95 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -153.72 -160.37 1.1 Allowed 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 -175.229 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.539 ' O ' ' O ' ' A' ' 28' ' ' CYS . 1.8 tt0 162.53 64.06 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 112.523 -2.126 . . . . 0.0 111.429 179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.647 ' HB2' ' CE1' ' A' ' 79' ' ' HIS . 0.6 OUTLIER 6.91 121.0 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 179.772 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.612 ' HA ' ' HG3' ' A' ' 13' ' ' GLN . 3.2 ttp -65.82 -72.3 0.16 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.904 177.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.45 ' N ' ' HG2' ' A' ' 29' ' ' MET . . . 102.02 104.72 2.81 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.731 -0.747 . . . . 0.0 113.112 179.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.559 ' O ' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -164.45 66.07 0.15 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.803 0.335 . . . . 0.0 110.882 179.387 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.499 ' SG ' ' HB2' ' A' ' 10' ' ' CYS . 85.2 m -97.65 -151.16 0.36 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.548 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.569 ' CZ ' ' OE1' ' A' ' 9' ' ' GLU . 0.7 OUTLIER -129.83 -162.75 1.23 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.667 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.621 ' O ' ' CB ' ' A' ' 35' ' ' ARG . 0.1 OUTLIER -138.7 123.8 19.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.299 -179.698 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.621 ' CB ' ' O ' ' A' ' 34' ' ' SER . 0.4 OUTLIER 146.83 -172.21 0.0 OUTLIER 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.015 179.568 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.583 ' O ' ' CD2' ' A' ' 37' ' ' TYR . . . -174.0 109.2 0.14 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.009 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.583 ' CD2' ' O ' ' A' ' 36' ' ' ALA . 18.6 m-85 -169.9 106.51 0.45 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.042 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -52.01 174.6 0.08 OUTLIER 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.947 2.432 . . . . 0.0 112.561 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.419 ' HA ' ' HD2' ' A' ' 40' ' ' PRO . 49.6 m -51.84 123.02 23.85 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.22 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.474 ' O ' ' C ' ' A' ' 41' ' ' LEU . 13.1 Cg_endo -57.38 169.51 2.2 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.744 2.296 . . . . 0.0 111.911 179.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.474 ' C ' ' O ' ' A' ' 40' ' ' PRO . 2.5 mt -31.27 -61.12 0.21 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.005 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.471 ' O ' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -42.17 170.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.973 -179.858 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.526 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -113.48 -66.13 1.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.992 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 43' ' ' SER . 1.7 mttm 73.04 -106.96 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.973 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.55 ' O ' ' OG1' ' A' ' 46' ' ' THR . 0.1 OUTLIER -126.82 -159.88 0.96 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.784 0.326 . . . . 0.0 111.177 -179.564 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.55 ' OG1' ' O ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER 70.67 48.0 0.45 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.979 -179.77 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.462 ' C ' ' O ' ' A' ' 46' ' ' THR . 6.2 mtp 32.23 -134.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.001 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.563 ' C ' HG23 ' A' ' 49' ' ' VAL . 2.5 mt -138.43 -170.04 2.73 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.629 0.252 . . . . 0.0 110.92 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.563 HG23 ' C ' ' A' ' 48' ' ' LEU . 0.3 OUTLIER 60.97 117.84 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.619 -179.576 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -70.63 145.03 50.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.116 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.488 ' HA ' ' HD3' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -118.81 33.7 5.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.773 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.58 159.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.385 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.407 ' C ' ' OG1' ' A' ' 54' ' ' THR . 0.0 OUTLIER -138.8 13.01 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.371 -179.953 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.422 ' HB ' ' CB ' ' A' ' 85' ' ' SER . 0.0 OUTLIER 58.45 45.15 17.02 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.002 179.982 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.514 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -49.28 162.84 0.12 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.373 -179.837 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.514 ' HB2' ' O ' ' A' ' 55' ' ' SER . 0.1 OUTLIER 83.92 90.63 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.394 179.572 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 59.9 179.72 0.09 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.547 179.447 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.483 ' HA ' ' HA ' ' A' ' 85' ' ' SER . 9.6 p -148.71 165.04 32.58 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.821 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.487 ' O ' HG22 ' A' ' 86' ' ' THR . 0.2 OUTLIER 163.66 127.09 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.903 0.382 . . . . 0.0 111.075 179.789 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 3.6 m -86.32 140.7 29.82 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.072 0.463 . . . . 0.0 111.544 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.766 HG12 ' O ' ' A' ' 61' ' ' VAL . 73.2 t -157.48 55.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.027 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.575 ' HA ' ' HA ' ' A' ' 82' ' ' CYS . . . 31.87 103.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.891 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.768 ' N ' ' O ' ' A' ' 81' ' ' ALA . 3.1 tptt -51.92 -36.33 48.63 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.706 0.765 . . . . 0.0 109.23 178.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.612 ' O ' ' N ' ' A' ' 80' ' ' THR . 74.9 m -150.08 118.84 6.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.39 -1.277 . . . . 0.0 109.919 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.846 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -105.23 166.31 10.5 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.531 0.681 . . . . 0.0 112.293 -178.811 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.793 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 0.1 OUTLIER -130.9 27.09 4.93 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-O 122.593 1.187 . . . . 0.0 107.921 177.399 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.686 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 12.9 ptt85 -11.0 100.7 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 112.475 -2.148 . . . . 0.0 111.689 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 1.015 HG13 ' HB2' ' A' ' 78' ' ' ASN . 4.2 m -98.32 45.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 CA-C-N 114.939 -1.028 . . . . 0.0 110.502 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.67 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 53.0 m -21.52 118.9 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.027 -179.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.831 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.2 OUTLIER -126.12 -167.49 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.784 0.802 . . . . 0.0 112.474 -178.457 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.658 ' H ' HG12 ' A' ' 70' ' ' VAL . 0.0 OUTLIER 39.17 -132.73 0.18 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.969 -179.888 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -78.97 19.65 5.13 Favored Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.735 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 113.06 41.43 0.98 Allowed Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.634 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.67 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.2 m-85 -72.53 178.6 3.96 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.604 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 5.9 mtmm -155.14 108.23 2.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.193 0.521 . . . . 0.0 111.454 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.244 HG21 ' CG2' ' A' ' 25' ' ' ILE . 15.4 m -106.59 15.02 7.52 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.483 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.337 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.846 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.6 OUTLIER 28.41 40.21 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 105.787 -1.931 . . . . 0.0 105.787 -176.876 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 1.015 ' HB2' HG13 ' A' ' 68' ' ' VAL . 29.1 t30 -4.89 68.92 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 113.402 -1.726 . . . . 0.0 108.722 -174.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.95 ' N ' HD12 ' A' ' 26' ' ' LEU . 36.4 m170 -37.77 122.11 0.95 Allowed 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 112.945 -1.934 . . . . 0.0 113.909 -176.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.612 ' N ' ' O ' ' A' ' 64' ' ' SER . 2.1 p -109.12 -11.73 14.9 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 113.048 -1.887 . . . . 0.0 109.211 178.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.768 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -172.38 142.49 1.31 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.4 179.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 8.1 m -120.82 146.22 46.78 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.679 0.276 . . . . 0.0 110.494 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.556 ' O ' ' HA ' ' A' ' 60' ' ' CYS . 0.8 OUTLIER -138.51 114.02 9.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.816 0.341 . . . . 0.0 111.8 -179.061 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.538 ' O ' ' CB ' ' A' ' 85' ' ' SER . 0.1 OUTLIER -77.69 89.09 3.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.803 179.415 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 3.0 p 158.25 94.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.106 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.53 ' HB ' ' O ' ' A' ' 85' ' ' SER . 4.4 t 170.94 47.39 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.946 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.429 ' HB2' ' HB2' ' A' ' 59' ' ' CYS . 0.5 OUTLIER -117.4 126.03 51.97 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.038 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -73.74 73.05 1.53 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.647 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -93.17 -167.55 1.74 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.428 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.52 ' O ' ' ND1' ' A' ' 90' ' ' HIS . 40.1 t-80 -142.23 71.21 1.34 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.786 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.484 ' O ' ' CB ' ' A' ' 92' ' ' SER . 0.2 OUTLIER -130.73 -78.27 0.53 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.79 179.955 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.484 ' CB ' ' O ' ' A' ' 91' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.872 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 1.009 ' H83' ' CB ' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.606 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.846 ' H3 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . 0.846 ' O2 ' ' H3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.697 ' HB3' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.893 0.377 . . . . 0.0 111.011 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.697 ' HD3' ' HB3' ' A' ' 1' ' ' ALA . 24.4 Cg_exo -63.03 -165.43 0.05 OUTLIER 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.853 2.369 . . . . 0.0 112.039 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -75.65 -62.64 1.51 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.67 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.49 HG13 ' O ' ' A' ' 4' ' ' VAL . 1.4 p -153.27 17.71 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.188 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -88.48 172.63 9.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.779 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -98.91 149.6 22.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.046 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -139.42 140.92 27.1 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.488 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -86.5 -177.88 2.51 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 122.87 2.38 . . . . 0.0 112.528 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.856 ' O ' HG22 ' A' ' 11' ' ' THR . 0.9 OUTLIER -86.14 137.81 32.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.031 0.443 . . . . 0.0 110.957 -179.834 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.439 ' N ' ' HG2' ' A' ' 9' ' ' GLU . 12.6 t -43.79 115.14 0.75 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.427 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.856 HG22 ' O ' ' A' ' 9' ' ' GLU . 3.9 t -175.86 -169.48 0.34 Allowed 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 121.183 0.516 . . . . 0.0 111.106 179.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.108 ' CD2' HD13 ' A' ' 26' ' ' LEU . 8.0 mp -85.9 130.31 34.58 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.465 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.614 ' O ' ' C ' ' A' ' 14' ' ' GLU . 2.0 mt-30 -91.39 49.01 1.54 Allowed 'General case' 0 CA--C 1.5 -0.95 0 CA-C-O 121.905 0.86 . . . . 0.0 110.278 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.614 ' C ' ' O ' ' A' ' 13' ' ' GLN . 27.5 tt0 -1.15 113.81 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 113.339 -1.755 . . . . 0.0 110.864 -178.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.925 ' ND2' HG11 ' A' ' 76' ' ' VAL . 1.4 t-20 -41.0 100.69 0.23 Allowed Pre-proline 0 C--N 1.301 -1.528 0 CA-C-N 113.293 -1.776 . . . . 0.0 112.349 -179.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -68.74 4.83 1.56 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.272 1.981 . . . . 0.0 110.664 178.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.586 ' CZ ' ' HG3' ' A' ' 71' ' ' MET . 10.9 t80 -110.63 -56.47 2.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.965 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.939 ' CE2' HG13 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -73.16 -26.53 61.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.535 179.777 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.531 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 8.9 m -47.26 97.57 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.928 -179.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.627 ' O ' ' N ' ' A' ' 22' ' ' GLY . 8.7 tt0 -136.04 139.7 31.01 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.443 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.485 ' HD2' ' HG3' ' A' ' 20' ' ' GLN . 87.9 Cg_exo -35.36 81.84 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.747 2.298 . . . . 0.0 112.417 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.627 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 130.93 -6.32 5.76 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.503 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.456 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . -159.73 101.65 1.47 Allowed Pre-proline 0 CA--C 1.513 -0.463 0 CA-C-O 121.992 0.901 . . . . 0.0 111.862 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.645 ' HD2' ' H3 ' ' A' ' 178' ' ' NAG . 91.6 Cg_endo -106.24 65.94 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.506 0 C-N-CA 124.981 3.787 . . . . 0.0 113.469 -178.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.195 ' CG2' HG21 ' A' ' 76' ' ' VAL . 16.2 mm -41.81 -176.41 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.368 179.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.108 HD13 ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -150.62 -160.52 1.18 Allowed 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -175.403 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.586 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 17.5 tt0 166.25 63.01 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 112.706 -2.043 . . . . 0.0 110.998 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.643 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 94.3 m -20.1 111.73 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.733 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.55 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -159.21 104.48 1.68 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.927 179.274 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -149.28 -133.79 2.26 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.602 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.2 m -153.4 122.51 6.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.684 0.278 . . . . 0.0 110.73 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 3.3 m -92.57 109.86 21.27 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.848 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -101.5 157.94 16.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.336 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.6 t 177.19 -71.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.593 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.2 mtp180 39.21 -160.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.104 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.564 ' O ' ' HB2' ' A' ' 37' ' ' TYR . . . -75.04 103.0 5.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.366 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.564 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 15.2 t80 153.28 65.59 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.7 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.67 176.13 10.49 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 C-N-CA 122.747 2.298 . . . . 0.0 112.595 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.481 ' HB ' ' CD ' ' A' ' 40' ' ' PRO . 4.3 p -150.03 169.08 9.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.858 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.481 ' CD ' ' HB ' ' A' ' 39' ' ' THR . 11.9 Cg_exo -70.17 -24.6 27.6 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.936 2.424 . . . . 0.0 112.057 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.422 ' O ' ' HB2' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -97.49 51.98 1.1 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.782 -179.892 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.422 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 1.3 tmm_? 167.88 -26.0 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.269 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.447 ' HB3' ' O ' ' A' ' 39' ' ' THR . 29.2 t -118.93 17.39 13.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.356 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? 54.97 -165.99 0.1 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.604 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -102.68 -22.79 13.9 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.787 0.327 . . . . 0.0 111.051 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -113.22 160.43 18.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.098 0.475 . . . . 0.0 111.344 -179.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.58 ' HG2' ' O ' ' A' ' 47' ' ' MET . 0.0 OUTLIER -176.52 93.69 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.534 179.549 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.624 ' C ' HG23 ' A' ' 49' ' ' VAL . 0.0 OUTLIER -103.82 72.78 1.13 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.27 -179.491 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.624 HG23 ' C ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER 55.03 166.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.929 0.395 . . . . 0.0 111.247 179.728 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -169.86 140.96 2.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.732 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -61.48 133.08 55.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.142 -179.722 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.406 ' HB2' ' O ' ' A' ' 51' ' ' LYS . 5.8 m120 64.71 107.62 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.089 179.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.499 ' O ' ' CB ' ' A' ' 54' ' ' THR . 35.4 t -140.32 153.66 22.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.296 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.565 ' CG2' ' O ' ' A' ' 54' ' ' THR . 0.4 OUTLIER 84.8 109.9 0.05 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.816 179.748 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.479 ' O ' ' C ' ' A' ' 56' ' ' GLU . 3.5 p -123.09 93.08 3.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.55 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.479 ' C ' ' O ' ' A' ' 55' ' ' SER . 0.1 OUTLIER -28.97 -96.07 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.52 -179.696 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -121.4 130.86 53.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.852 0.358 . . . . 0.0 111.013 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.505 ' HA ' ' HA ' ' A' ' 86' ' ' THR . 42.1 p -106.07 -176.67 3.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.086 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.55 ' SG ' ' N ' ' A' ' 87' ' ' CYS . 0.3 OUTLIER -157.97 126.03 5.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.384 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 82' ' ' CYS . 0.6 OUTLIER -75.89 104.07 6.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.595 -179.499 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.518 ' O ' ' C ' ' A' ' 62' ' ' ALA . 18.0 t -102.38 73.7 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.342 179.09 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.739 ' HB1' ' O ' ' A' ' 64' ' ' SER . . . 13.0 99.65 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -179.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.925 ' N ' ' O ' ' A' ' 81' ' ' ALA . 0.9 OUTLIER -50.29 -35.24 26.5 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.307 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.739 ' O ' ' HB1' ' A' ' 62' ' ' ALA . 22.6 m -136.28 -174.88 3.81 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 113.768 -1.56 . . . . 0.0 108.877 179.164 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.723 ' HB3' ' HB3' ' A' ' 77' ' ' GLU . 1.8 p90 -164.05 162.97 23.38 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.498 0.666 . . . . 0.0 112.331 -179.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.827 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -134.99 29.36 3.43 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 176.468 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.736 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 1.8 ptt85 -10.76 130.0 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 112.109 -2.314 . . . . 0.0 112.368 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 1.013 HG21 HG13 ' A' ' 25' ' ' ILE . 2.5 m -135.28 38.2 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.094 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.586 ' C ' ' O ' ' A' ' 68' ' ' VAL . 23.1 m -4.5 119.23 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.661 -1.154 . . . . 0.0 112.336 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.939 HG13 ' CE2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -111.16 -161.29 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-O 121.78 0.8 . . . . 0.0 111.593 179.108 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.586 ' HG3' ' CZ ' ' A' ' 17' ' ' PHE . 3.7 mtt -30.89 153.6 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.901 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 42.13 25.85 0.29 Allowed Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.46 -0.876 . . . . 0.0 111.552 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.503 ' C ' HG23 ' A' ' 69' ' ' THR . . . 68.96 30.82 72.22 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.128 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.586 ' HB2' HG23 ' A' ' 70' ' ' VAL . 8.0 m-30 -46.59 179.36 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.625 0.25 . . . . 0.0 110.331 179.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.53 ' CG ' ' O ' ' A' ' 74' ' ' PHE . 9.7 mtpt -161.58 93.0 0.9 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.133 0.492 . . . . 0.0 111.432 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.195 HG21 ' CG2' ' A' ' 25' ' ' ILE . 27.3 m -85.82 9.1 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.486 -1.488 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.903 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.738 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 29.49 39.62 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 -177.084 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.857 ' HB2' HG13 ' A' ' 68' ' ' VAL . 61.3 t30 3.91 62.15 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 113.123 -1.853 . . . . 0.0 108.448 -174.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 1.042 ' O ' HD21 ' A' ' 12' ' ' LEU . 35.7 m170 -31.7 120.95 0.27 Allowed 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 112.778 -2.01 . . . . 0.0 113.7 -176.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.501 ' OG1' ' HB2' ' A' ' 64' ' ' SER . 7.5 p -107.7 -10.88 15.53 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 113.84 -1.527 . . . . 0.0 110.1 179.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.925 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -170.44 133.03 1.02 Allowed 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.908 178.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.594 ' SG ' ' CD1' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -116.67 142.38 46.97 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.27 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.469 ' CG ' ' O ' ' A' ' 83' ' ' HIS . 0.6 OUTLIER -126.1 115.17 19.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.816 0.341 . . . . 0.0 110.828 179.635 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 68.3 m -58.8 105.76 0.34 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.026 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.488 ' O ' ' SG ' ' A' ' 59' ' ' CYS . 0.9 OUTLIER -144.42 115.5 7.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.139 179.907 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.505 ' HA ' ' HA ' ' A' ' 58' ' ' THR . 0.2 OUTLIER -30.87 153.5 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.359 179.861 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.55 ' N ' ' SG ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER -115.25 46.09 1.52 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.713 179.759 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.426 ' O ' ' C ' ' A' ' 89' ' ' TYR . 1.2 m-30 -119.38 62.72 0.8 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.767 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 88' ' ' TYR . 0.4 OUTLIER 36.21 80.81 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.738 -179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -148.43 135.3 19.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.929 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -118.87 102.43 8.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.828 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.275 -0.869 . . . . 0.0 110.808 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 0.939 ' H82' HD11 ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . 0.772 ' H5 ' ' H2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.441 ' H3 ' ' O7 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . 0.772 ' H2 ' ' H5 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.404 ' HA ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.872 0.367 . . . . 0.0 111.042 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 1' ' ' ALA . 25.7 Cg_endo -62.23 120.76 8.48 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.649 2.233 . . . . 0.0 111.83 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -88.01 47.2 1.47 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.355 -179.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.562 ' O ' ' O ' ' A' ' 5' ' ' GLN . 1.0 OUTLIER -106.9 -0.58 9.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.941 0.4 . . . . 0.0 110.898 179.574 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.562 ' O ' ' O ' ' A' ' 4' ' ' VAL . 0.2 OUTLIER 29.11 -154.64 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.153 179.723 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 41.22 64.88 0.91 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.075 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -44.44 136.6 4.19 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 120.822 0.344 . . . . 0.0 110.729 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.427 ' HD2' ' SG ' ' A' ' 31' ' ' CYS . 35.0 Cg_endo -64.54 -160.77 0.04 OUTLIER 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.703 2.269 . . . . 0.0 112.213 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 56.1 tt0 -93.9 158.15 15.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.536 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.446 ' HB2' ' C ' ' A' ' 31' ' ' CYS . 14.6 t -100.3 147.22 26.02 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.031 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.637 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 3.7 t -178.92 -167.76 0.12 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.419 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.023 HD23 HD13 ' A' ' 26' ' ' LEU . 3.9 mp -97.2 139.21 33.51 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.392 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.634 ' O ' ' O ' ' A' ' 14' ' ' GLU . 28.7 mt-30 -111.24 55.04 0.66 Allowed 'General case' 0 CA--C 1.505 -0.752 0 CA-C-O 121.658 0.742 . . . . 0.0 110.736 179.093 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.634 ' O ' ' O ' ' A' ' 13' ' ' GLN . 14.7 tt0 -0.16 122.63 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 113.651 -1.613 . . . . 0.0 111.311 -179.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.802 ' HB2' HG22 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -63.46 102.69 0.34 Allowed Pre-proline 0 C--N 1.305 -1.341 0 CA-C-N 114.107 -1.406 . . . . 0.0 112.7 -179.015 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.537 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 6.3 Cg_exo -76.72 5.09 5.08 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.632 2.221 . . . . 0.0 109.41 177.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.525 ' HB3' ' OD1' ' A' ' 15' ' ' ASN . 0.9 OUTLIER -96.85 -62.28 1.28 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 113.86 -1.518 . . . . 0.0 110.525 -179.668 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 1.132 ' CG ' HG21 ' A' ' 70' ' ' VAL . 7.3 m-85 -77.76 -4.86 48.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.86 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.488 ' HA ' ' O ' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -52.23 91.52 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.127 179.477 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.673 ' O ' ' N ' ' A' ' 22' ' ' GLY . 4.6 mt-30 -95.09 162.59 24.39 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.357 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.573 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 11.4 Cg_endo -54.86 63.48 0.03 OUTLIER 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.761 2.307 . . . . 0.0 111.802 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.673 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 143.53 1.08 1.07 Allowed Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.805 -0.712 . . . . 0.0 113.133 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.992 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -155.13 108.61 2.27 Favored Pre-proline 0 CA--C 1.518 -0.258 0 CA-C-O 122.074 0.94 . . . . 0.0 112.804 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.8 ' HD2' ' H3 ' ' A' ' 178' ' ' NAG . 94.9 Cg_endo -98.78 78.52 0.05 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.073 0 C-N-CA 124.844 3.696 . . . . 0.0 112.913 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.23 ' CG2' HG21 ' A' ' 76' ' ' VAL . 5.1 mm -43.9 -176.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.026 HD23 ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.21 -164.87 2.07 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 122.343 1.068 . . . . 0.0 113.612 -176.297 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.662 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER 165.55 78.87 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 112.939 -1.937 . . . . 0.0 111.051 178.868 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.637 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -13.35 114.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.265 -179.851 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.591 ' HB2' ' CG ' ' A' ' 13' ' ' GLN . 9.8 mmm -126.99 123.87 38.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.885 0.374 . . . . 0.0 111.241 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 136.72 -145.48 17.34 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.382 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.446 ' C ' ' HB2' ' A' ' 10' ' ' CYS . 1.6 p -163.21 170.38 17.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.82 0.343 . . . . 0.0 110.811 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.45 -167.49 0.18 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.809 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.442 ' CD1' ' N ' ' A' ' 33' ' ' PHE . 3.3 m-85 -106.14 -159.13 0.69 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.546 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.7 p -148.58 -158.92 0.96 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.835 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.472 ' CG ' ' O ' ' A' ' 35' ' ' ARG . 1.6 ptm180 -105.19 36.94 2.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.723 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 60.6 151.13 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.899 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.421 ' O ' ' O ' ' A' ' 38' ' ' PRO . 47.0 t80 -137.01 78.78 39.99 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.7 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.421 ' O ' ' O ' ' A' ' 37' ' ' TYR . 52.8 Cg_exo -53.54 -159.02 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.855 2.37 . . . . 0.0 112.238 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.512 HG22 HD21 ' A' ' 41' ' ' LEU . 0.6 OUTLIER -121.36 63.84 13.84 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.638 179.818 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.478 ' C ' HD23 ' A' ' 41' ' ' LEU . 26.9 Cg_endo -62.58 118.51 5.41 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.84 2.36 . . . . 0.0 112.183 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.512 HD21 HG22 ' A' ' 39' ' ' THR . 9.9 mt -114.26 -161.69 0.78 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.237 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.45 ' O ' ' CG ' ' A' ' 42' ' ' ARG . 5.9 tpt180 -85.52 55.16 3.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.652 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 39.1 t -143.32 -74.64 0.27 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.791 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -146.37 -160.88 1.21 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.854 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.64 95.2 2.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.775 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.4 ' O ' ' C ' ' A' ' 47' ' ' MET . 20.1 p -96.73 -153.66 0.42 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.018 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.4 ' C ' ' O ' ' A' ' 46' ' ' THR . 0.1 OUTLIER 38.03 47.47 0.94 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.794 179.948 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -150.38 94.71 2.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.063 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.554 HG23 ' CD ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -113.13 -172.02 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.638 179.563 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -83.52 68.31 9.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.933 0.397 . . . . 0.0 111.331 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.554 ' CD ' HG23 ' A' ' 49' ' ' VAL . 12.6 mtpp -106.57 100.42 9.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.373 179.493 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.477 ' C ' ' O ' ' A' ' 51' ' ' LYS . 0.8 OUTLIER -31.24 99.29 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.14 -179.663 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 37.9 t -55.62 145.49 5.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.9 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 69.5 p -86.07 -133.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.493 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.8 -178.31 3.52 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.741 0.305 . . . . 0.0 111.134 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -115.03 -97.37 0.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.954 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.516 ' OG ' ' N ' ' A' ' 58' ' ' THR . 1.2 t -39.59 -92.85 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.046 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.798 HG22 ' HA ' ' A' ' 85' ' ' SER . 0.0 OUTLIER 51.93 164.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.816 -179.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 61.7 m -153.01 150.19 28.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.951 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -95.87 128.8 43.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.821 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.539 HG12 ' O ' ' A' ' 61' ' ' VAL . 61.0 t -131.56 64.47 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.738 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.58 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 21.15 103.43 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.992 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.86 ' N ' ' O ' ' A' ' 81' ' ' ALA . 15.1 tttt -54.18 -35.67 62.58 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.538 0.685 . . . . 0.0 109.335 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.537 ' O ' ' N ' ' A' ' 80' ' ' THR . 37.1 m -146.3 127.41 14.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.379 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.854 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -112.31 166.11 11.58 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.594 0.711 . . . . 0.0 112.576 -178.343 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.715 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -133.1 29.52 4.04 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 114.612 -1.176 . . . . 0.0 108.198 177.393 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.737 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.8 OUTLIER -16.13 125.31 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 112.426 -2.17 . . . . 0.0 111.6 -179.718 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.99 HG11 ' H82' ' A' ' 178' ' ' NAG . 2.7 m -128.57 41.92 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.328 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.65 ' C ' ' O ' ' A' ' 68' ' ' VAL . 55.0 m -9.75 118.35 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.665 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 1.132 HG21 ' CG ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -124.45 -171.1 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 121.52 0.676 . . . . 0.0 111.962 -178.765 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.476 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 42.6 mmm 34.3 -127.65 0.08 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.829 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -81.69 26.27 3.69 Favored Glycine 0 N--CA 1.44 -1.057 0 CA-C-N 115.498 -0.774 . . . . 0.0 112.566 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.607 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 104.69 43.02 1.74 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.468 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.612 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.0 m-85 -85.79 116.1 23.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.811 0.339 . . . . 0.0 111.011 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -99.65 104.5 16.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.121 0.486 . . . . 0.0 112.243 -179.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.23 HG21 ' CG2' ' A' ' 25' ' ' ILE . 12.6 m -92.32 14.64 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.361 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.755 178.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.854 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 29.18 39.94 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 105.508 -2.034 . . . . 0.0 105.508 -176.426 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.724 ' HB2' HG13 ' A' ' 68' ' ' VAL . 46.6 t30 -2.2 67.9 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.828 0 CA-C-N 113.245 -1.798 . . . . 0.0 108.53 -175.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 1.025 ' N ' HD12 ' A' ' 26' ' ' LEU . 37.6 m170 -35.49 120.48 0.56 Allowed 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 113.264 -1.789 . . . . 0.0 113.877 -176.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.537 ' N ' ' O ' ' A' ' 64' ' ' SER . 3.9 p -111.16 -11.16 14.27 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 113.514 -1.675 . . . . 0.0 110.233 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.86 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -168.83 133.4 1.54 Allowed 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.586 ' SG ' HD11 ' A' ' 12' ' ' LEU . 1.3 m -119.74 137.16 54.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.919 0.39 . . . . 0.0 111.077 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.563 ' O ' ' CD2' ' A' ' 83' ' ' HIS . 0.6 OUTLIER -137.57 130.98 31.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.9 -179.855 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.522 ' O ' ' HB3' ' A' ' 85' ' ' SER . 0.0 OUTLIER -62.88 -175.45 0.09 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.932 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.798 ' HA ' HG22 ' A' ' 58' ' ' THR . 25.6 t 77.34 158.42 0.19 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.099 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 85' ' ' SER . 4.9 p 64.4 114.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.169 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.8 136.83 42.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.709 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 46.19 55.53 7.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.346 -179.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.552 ' CG ' ' O ' ' A' ' 89' ' ' TYR . 0.9 OUTLIER -125.1 114.96 19.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.359 -179.484 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -132.12 -177.37 4.42 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.798 179.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.15 98.63 0.06 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.62 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.98 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 0.992 ' H83' ' HB1' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.755 ' O7 ' ' C3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . 0.665 ' H4 ' ' C5 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . 0.665 ' C5 ' ' H4 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . 0.407 ' O7 ' ' H3 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.521 ' O7 ' ' O3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.969 ' HB3' ' HB ' ' A' ' 4' ' ' VAL . . . . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.977 0.418 . . . . 0.0 111.068 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -62.07 78.86 0.1 OUTLIER 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.785 2.323 . . . . 0.0 112.344 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.466 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 0.2 OUTLIER 74.81 46.68 0.13 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.113 179.847 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.969 ' HB ' ' HB3' ' A' ' 1' ' ' ALA . 48.7 t -134.56 68.23 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.017 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.435 ' O ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER 67.24 132.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.817 -179.841 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.435 ' O ' ' O ' ' A' ' 5' ' ' GLN . 6.9 m-20 -51.1 -172.86 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.914 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.407 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.1 OUTLIER -36.84 127.54 0.75 Allowed Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.964 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 7' ' ' CYS . 37.0 Cg_exo -59.45 -160.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.799 2.332 . . . . 0.0 112.037 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -105.18 135.3 46.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.196 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.507 ' HA ' ' HA3' ' A' ' 30' ' ' GLY . 3.0 t -41.37 131.18 2.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.314 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.75 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 1.7 t -155.48 -163.65 1.57 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.259 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.055 HD21 ' O ' ' A' ' 79' ' ' HIS . 6.8 mp -98.32 138.69 35.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.015 0.436 . . . . 0.0 111.812 -179.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.707 ' O ' ' O ' ' A' ' 14' ' ' GLU . 20.2 mt-30 -115.14 52.28 0.87 Allowed 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 121.713 0.768 . . . . 0.0 110.79 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.707 ' O ' ' O ' ' A' ' 13' ' ' GLN . 8.3 tt0 7.7 126.35 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 113.327 -1.76 . . . . 0.0 112.336 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.966 ' ND2' HG11 ' A' ' 76' ' ' VAL . 1.4 t-20 -53.81 108.74 1.2 Allowed Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.249 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -74.12 20.71 0.4 Allowed 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.22 1.947 . . . . 0.0 111.727 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.622 ' CZ ' ' HG2' ' A' ' 71' ' ' MET . 34.8 t80 -128.34 -55.4 1.25 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.58 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 1.023 ' CD2' HG13 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -71.69 -24.34 61.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.685 -179.772 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.664 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.2 m -40.03 92.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.182 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.607 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -124.29 138.89 31.68 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.592 -179.394 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.508 ' N ' ' OE1' ' A' ' 20' ' ' GLN . 83.4 Cg_exo -37.41 83.67 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.534 2.156 . . . . 0.0 112.08 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.607 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 127.37 -9.59 6.94 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.537 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.653 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -154.75 99.48 2.41 Favored Pre-proline 0 CA--C 1.512 -0.508 0 CA-C-O 122.011 0.91 . . . . 0.0 111.486 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.7 ' O ' ' O ' ' A' ' 25' ' ' ILE . 71.7 Cg_endo -103.63 66.67 0.03 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.57 0 C-N-CA 124.954 3.769 . . . . 0.0 112.608 -178.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.198 ' CG2' HG21 ' A' ' 76' ' ' VAL . 25.1 mm -37.59 -178.03 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.002 0 CA-C-N 115.322 -0.853 . . . . 0.0 113.284 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.922 HD13 ' O ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -153.78 -159.57 0.99 Allowed 'General case' 0 CA--C 1.498 -1.054 0 CA-C-O 122.726 1.25 . . . . 0.0 114.193 -175.343 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.598 ' O ' ' C ' ' A' ' 28' ' ' CYS . 0.8 OUTLIER 168.58 65.85 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 112.716 -2.038 . . . . 0.0 111.297 179.13 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.75 ' HA ' ' O ' ' A' ' 11' ' ' THR . 68.0 m -5.98 113.04 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.935 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.616 ' N ' ' O ' ' A' ' 11' ' ' THR . 3.3 tpp -141.29 108.9 5.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.84 0.352 . . . . 0.0 111.226 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.507 ' HA3' ' HA ' ' A' ' 10' ' ' CYS . . . -162.63 -130.12 1.09 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.356 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.41 ' O ' ' O ' ' A' ' 32' ' ' CYS . 0.0 OUTLIER -143.77 116.79 8.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.746 0.308 . . . . 0.0 110.965 -179.941 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.434 ' HB3' ' HB3' ' A' ' 84' ' ' CYS . 56.4 m -53.04 -169.57 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.001 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.468 ' O ' ' CB ' ' A' ' 34' ' ' SER . 0.7 OUTLIER -124.22 163.28 21.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.557 179.734 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.468 ' CB ' ' O ' ' A' ' 33' ' ' PHE . 1.3 t 82.25 53.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.711 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.412 ' N ' ' CD ' ' A' ' 35' ' ' ARG . 0.1 OUTLIER -53.25 126.9 22.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.951 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -124.82 174.26 8.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.885 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -120.36 155.54 56.16 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.938 0.399 . . . . 0.0 111.066 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -61.43 -175.84 0.16 Allowed 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.957 2.438 . . . . 0.0 112.514 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.422 ' O ' ' N ' ' A' ' 41' ' ' LEU . 0.8 OUTLIER -50.78 105.16 0.48 Allowed Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.851 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.503 ' O ' ' C ' ' A' ' 41' ' ' LEU . 24.1 Cg_exo -63.99 67.12 0.21 Allowed 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.918 2.412 . . . . 0.0 111.841 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.542 ' O ' ' CB ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -26.7 123.65 0.08 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.331 -179.588 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.542 ' CB ' ' O ' ' A' ' 41' ' ' LEU . 0.6 OUTLIER 155.79 -31.5 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.457 179.917 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.436 ' O ' ' O ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER 58.67 -80.83 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.152 179.62 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.508 ' HG3' ' SD ' ' A' ' 47' ' ' MET . 0.8 OUTLIER 59.57 134.31 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.774 -179.778 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.544 ' O ' ' O ' ' A' ' 46' ' ' THR . 0.1 OUTLIER -111.62 140.6 46.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.942 0.401 . . . . 0.0 111.515 -179.546 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.57 ' O ' ' HB3' ' A' ' 47' ' ' MET . 1.0 OUTLIER 27.83 105.66 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.095 179.33 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.57 ' HB3' ' O ' ' A' ' 46' ' ' THR . 20.3 ptm 155.07 161.52 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.651 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.516 ' CB ' ' O ' ' A' ' 47' ' ' MET . 0.2 OUTLIER 85.15 -174.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.944 179.994 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -127.57 -154.15 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.016 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 75.32 165.25 0.27 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.069 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.475 ' HE3' ' OG1' ' A' ' 54' ' ' THR . 0.0 OUTLIER -73.85 172.57 11.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.751 179.975 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.409 ' O ' ' O ' ' A' ' 53' ' ' VAL . 23.9 p30 -105.67 144.79 31.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.87 0.367 . . . . 0.0 111.146 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.409 ' O ' ' O ' ' A' ' 52' ' ' ASN . 10.5 t 57.96 149.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.34 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.716 ' O ' ' CB ' ' A' ' 55' ' ' SER . 2.8 m 177.74 135.65 0.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.37 -179.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.716 ' CB ' ' O ' ' A' ' 54' ' ' THR . 44.2 t 120.17 87.26 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.93 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.509 ' OE1' ' HA ' ' A' ' 85' ' ' SER . 0.0 OUTLIER -67.03 176.37 2.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.738 179.719 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.471 ' O ' ' O ' ' A' ' 58' ' ' THR . 14.4 p -74.33 -27.22 60.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.684 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.479 ' N ' ' OE1' ' A' ' 56' ' ' GLU . 0.5 OUTLIER 57.24 148.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.695 -179.879 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.479 ' SG ' ' O ' ' A' ' 85' ' ' SER . 28.0 p 175.78 121.13 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.958 0.408 . . . . 0.0 111.348 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.4 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 0.0 OUTLIER -96.89 57.07 1.49 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.619 179.684 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.583 HG12 ' O ' ' A' ' 61' ' ' VAL . 32.5 t -76.51 49.92 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.975 0.416 . . . . 0.0 111.478 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.712 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 40.23 114.49 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.661 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.753 ' N ' ' O ' ' A' ' 81' ' ' ALA . 13.1 tttm -56.08 -37.1 68.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.52 0.676 . . . . 0.0 109.179 178.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.648 ' O ' ' N ' ' A' ' 80' ' ' THR . 70.7 m -143.71 117.51 9.31 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.379 179.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.751 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 2.5 p90 -106.35 162.4 13.71 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.847 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -132.95 27.82 4.22 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 107.613 -1.255 . . . . 0.0 107.613 176.67 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.682 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.2 OUTLIER -6.64 129.69 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 112.201 -2.272 . . . . 0.0 112.522 -179.424 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 1.084 HG21 ' CD1' ' A' ' 25' ' ' ILE . 4.9 m -138.76 53.31 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 114.585 -1.188 . . . . 0.0 110.302 179.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.657 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 17.7 m -24.91 118.22 0.05 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.182 0.515 . . . . 0.0 111.466 -178.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 1.023 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -109.82 -171.21 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.283 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.622 ' HG2' ' CZ ' ' A' ' 17' ' ' PHE . 3.0 mtp 30.23 -149.68 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.51 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.478 ' H ' ' HB3' ' A' ' 71' ' ' MET . . . -46.76 -20.39 0.65 Allowed Glycine 0 N--CA 1.438 -1.181 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.822 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.64 ' C ' HG23 ' A' ' 69' ' ' THR . . . 152.78 32.41 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.665 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.657 ' O ' ' HA ' ' A' ' 69' ' ' THR . 9.1 m-30 -53.09 179.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.53 0.205 . . . . 0.0 110.81 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.569 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -155.0 103.4 2.39 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.883 0.373 . . . . 0.0 111.184 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.198 HG21 ' CG2' ' A' ' 25' ' ' ILE . 27.4 m -100.49 10.94 7.19 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.034 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.751 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 27.87 40.35 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 105.384 -2.08 . . . . 0.0 105.384 -177.092 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.929 ' HB2' HG13 ' A' ' 68' ' ' VAL . 48.0 t30 3.26 64.58 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 113.253 -1.794 . . . . 0.0 108.593 -174.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 1.055 ' O ' HD21 ' A' ' 12' ' ' LEU . 37.8 m170 -38.07 120.4 0.86 Allowed 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 112.779 -2.01 . . . . 0.0 113.154 -176.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.648 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.0 OUTLIER -110.19 -7.52 14.86 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 113.533 -1.667 . . . . 0.0 109.466 179.455 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.753 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -173.76 142.2 0.89 Allowed 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.253 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.658 ' SG ' HD12 ' A' ' 12' ' ' LEU . 3.2 m -115.93 163.13 16.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.305 0.574 . . . . 0.0 111.457 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.519 ' CG ' ' O ' ' A' ' 83' ' ' HIS . 6.1 p80 -165.58 107.27 0.77 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.128 179.034 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.467 ' O ' ' CB ' ' A' ' 85' ' ' SER . 0.9 OUTLIER -88.2 115.93 26.04 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.729 -179.72 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.514 ' O ' ' C ' ' A' ' 86' ' ' THR . 0.0 OUTLIER 163.44 151.25 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.173 179.98 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.514 ' C ' ' O ' ' A' ' 85' ' ' SER . 17.9 m -24.45 103.92 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.274 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.485 ' SG ' ' CG2' ' A' ' 61' ' ' VAL . 53.2 m -59.96 138.15 57.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.086 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.454 ' O ' ' HB2' ' A' ' 89' ' ' TYR . 45.8 t80 59.31 76.05 0.37 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.074 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.454 ' HB2' ' O ' ' A' ' 88' ' ' TYR . 49.9 t80 176.85 73.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.005 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -71.76 113.45 8.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.01 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.44 59.54 1.09 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.615 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.936 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 0.777 ' H82' HD11 ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.481 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . 0.672 ' O2 ' ' C5 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . 0.672 ' C5 ' ' O2 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . 0.646 ' H62' ' H82' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . 0.646 ' H82' ' H62' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.472 ' C6 ' ' O5 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . 0.472 ' O5 ' ' C6 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.439 ' HB1' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.949 0.404 . . . . 0.0 110.97 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.439 ' HD2' ' HB1' ' A' ' 1' ' ' ALA . 63.7 Cg_exo -52.03 -66.44 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.696 2.264 . . . . 0.0 112.234 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.491 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 9.5 p-10 -61.42 143.77 55.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.79 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.0 m -142.57 123.81 11.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.292 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -129.19 133.57 47.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.792 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 172.62 34.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.114 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 55.75 58.67 9.88 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.182 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.67 71.22 4.04 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.755 2.303 . . . . 0.0 111.782 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 63.53 121.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.538 -179.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.591 ' CB ' ' O ' ' A' ' 31' ' ' CYS . 43.5 t -51.78 159.3 0.84 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.456 0.646 . . . . 0.0 111.524 -179.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.716 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 0.6 OUTLIER -179.28 -160.71 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.709 179.746 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.793 HD21 ' CB ' ' A' ' 79' ' ' HIS . 10.8 mp -90.2 128.37 36.35 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.164 0.507 . . . . 0.0 111.59 -179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.619 ' O ' ' C ' ' A' ' 14' ' ' GLU . 5.0 mt-30 -96.52 46.96 1.06 Allowed 'General case' 0 CA--C 1.502 -0.867 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.775 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.79 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -0.29 117.1 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 113.775 -1.557 . . . . 0.0 110.797 -179.138 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.778 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.7 OUTLIER -54.88 101.96 0.28 Allowed Pre-proline 0 C--N 1.31 -1.119 0 CA-C-N 114.552 -1.204 . . . . 0.0 112.413 -178.637 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.592 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 61.8 Cg_endo -73.67 7.41 2.34 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 122.091 1.861 . . . . 0.0 110.003 177.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.54 ' HB3' ' OD1' ' A' ' 15' ' ' ASN . 1.5 t80 -102.81 -60.7 1.5 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.191 -1.368 . . . . 0.0 110.102 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.925 ' HD2' HG21 ' A' ' 25' ' ' ILE . 3.2 m-85 -82.93 3.76 28.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.459 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.833 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 15.0 t -64.07 99.11 0.24 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.558 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.627 ' N ' ' O ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -102.26 170.33 6.5 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.991 179.046 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.542 ' HA ' ' O2 ' ' A' ' 186' ' ' GAL . 14.7 Cg_endo -57.45 73.12 0.04 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 122.454 2.103 . . . . 0.0 111.94 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.535 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 133.79 -9.61 4.89 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.359 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 1.143 ' CB ' ' H83' ' A' ' 178' ' ' NAG . . . -146.12 104.0 4.11 Favored Pre-proline 0 CA--C 1.509 -0.6 0 CA-C-O 121.81 0.815 . . . . 0.0 111.247 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.864 ' O ' ' O ' ' A' ' 25' ' ' ILE . 78.3 Cg_endo -97.06 25.39 0.25 Allowed 'Trans proline' 0 N--CA 1.449 -1.133 0 C-N-CA 124.46 3.44 . . . . 0.0 113.477 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.176 ' CG2' HG21 ' A' ' 76' ' ' VAL . 10.7 mm 21.94 -175.03 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 114.932 -1.031 . . . . 0.0 112.843 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.968 ' H ' HG22 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -158.76 -166.08 1.79 Allowed 'General case' 0 CA--C 1.498 -1.043 0 N-CA-C 115.656 1.725 . . . . 0.0 115.656 -174.743 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.558 ' CG ' ' O ' ' A' ' 27' ' ' GLN . 0.5 OUTLIER 166.54 66.99 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 111.561 -2.563 . . . . 0.0 110.75 179.642 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.797 ' HB2' ' HD1' ' A' ' 79' ' ' HIS . 0.1 OUTLIER -19.1 116.07 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.485 -0.779 . . . . 0.0 112.117 -179.089 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.555 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.2 OUTLIER -147.39 123.06 10.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.275 179.271 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.564 ' HA3' ' HA ' ' A' ' 10' ' ' CYS . . . 169.31 -136.51 4.08 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.974 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.591 ' O ' ' CB ' ' A' ' 10' ' ' CYS . 95.0 m -126.8 163.35 23.76 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.778 0.323 . . . . 0.0 111.075 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.511 ' C ' ' CD1' ' A' ' 33' ' ' PHE . 4.9 m -139.19 142.02 37.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.997 0.427 . . . . 0.0 111.476 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.518 ' CD1' ' N ' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -135.93 -172.84 3.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.383 179.239 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 6.7 t -76.6 -69.07 0.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.795 0.331 . . . . 0.0 110.604 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.516 ' CG ' ' N ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 54.08 168.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.384 179.594 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.516 ' N ' ' CG ' ' A' ' 35' ' ' ARG . . . 37.64 88.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.83 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.657 ' HB3' ' HD3' ' A' ' 38' ' ' PRO . 0.6 OUTLIER -118.13 -53.44 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.874 179.29 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.668 ' O ' HG23 ' A' ' 39' ' ' THR . 23.3 Cg_exo -63.96 176.74 2.26 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.505 2.137 . . . . 0.0 111.951 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.668 HG23 ' O ' ' A' ' 38' ' ' PRO . 0.1 OUTLIER 176.82 169.06 0.42 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 120.91 0.386 . . . . 0.0 111.201 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.523 ' HD2' ' CB ' ' A' ' 39' ' ' THR . 17.6 Cg_endo -57.69 76.08 0.04 OUTLIER 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.92 2.413 . . . . 0.0 112.355 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.472 ' O ' ' HB2' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -172.13 60.65 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.578 179.888 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.472 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 0.9 OUTLIER 70.99 142.04 0.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.974 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.1 t -154.05 -123.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.638 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.548 ' O ' ' O ' ' A' ' 45' ' ' LYS . 2.2 mmtp 59.74 -177.97 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.052 0.453 . . . . 0.0 111.701 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.548 ' O ' ' O ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER 0.69 121.77 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.215 -0.902 . . . . 0.0 112.86 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.466 ' O ' ' CB ' ' A' ' 47' ' ' MET . 1.8 t -114.17 156.23 24.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.306 179.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.466 ' CB ' ' O ' ' A' ' 46' ' ' THR . 0.0 OUTLIER 161.78 97.88 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.708 -179.764 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.439 HD12 ' H ' ' A' ' 47' ' ' MET . 5.1 mp -146.71 143.52 28.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.932 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.446 ' H ' HG23 ' A' ' 49' ' ' VAL . 1.5 t -56.03 118.82 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.973 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.487 ' CG ' ' O ' ' A' ' 50' ' ' GLN . 0.4 OUTLIER -88.78 36.32 0.8 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.648 179.751 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.504 ' HB3' ' ND2' ' A' ' 52' ' ' ASN . 12.0 tttt -86.05 -159.07 0.44 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.743 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.504 ' ND2' ' HB3' ' A' ' 51' ' ' LYS . 0.0 OUTLIER 49.82 36.79 11.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.171 179.615 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.808 HG23 ' N ' ' A' ' 54' ' ' THR . 1.0 OUTLIER 36.29 -160.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.226 179.849 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.808 ' N ' HG23 ' A' ' 53' ' ' VAL . 5.4 t 175.72 37.14 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.274 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.438 ' O ' ' OG ' ' A' ' 55' ' ' SER . 8.3 p -133.86 87.81 2.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.89 0.376 . . . . 0.0 111.058 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.512 ' O ' ' OG ' ' A' ' 57' ' ' SER . 15.0 tt0 -84.59 -84.69 0.14 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.107 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.512 ' OG ' ' O ' ' A' ' 56' ' ' GLU . 1.2 m -173.23 101.9 0.12 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.868 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -133.82 156.45 48.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.923 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.495 ' O ' ' SG ' ' A' ' 87' ' ' CYS . 0.7 OUTLIER -179.37 126.4 0.09 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.156 179.91 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.442 ' C ' ' O ' ' A' ' 59' ' ' CYS . 0.1 OUTLIER -34.22 137.79 0.1 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.091 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.642 HG23 ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -150.15 71.47 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.52 179.779 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.587 ' HA ' ' O ' ' A' ' 81' ' ' ALA . . . 4.2 101.5 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.745 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.786 ' N ' ' O ' ' A' ' 81' ' ' ALA . 0.1 OUTLIER -54.4 -33.48 59.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.502 0.668 . . . . 0.0 109.749 178.291 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.48 ' O ' ' N ' ' A' ' 80' ' ' THR . 17.2 m -151.46 125.88 9.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.843 -1.072 . . . . 0.0 109.744 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.898 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.3 OUTLIER -106.33 163.94 12.43 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.278 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.781 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.9 OUTLIER -130.34 27.45 5.05 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 177.243 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.706 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 3.9 ptt-85 -12.39 99.81 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 112.515 -2.13 . . . . 0.0 111.623 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 1.013 HG13 ' HB2' ' A' ' 78' ' ' ASN . 8.2 m -97.61 45.9 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 CA-C-N 114.683 -1.144 . . . . 0.0 109.837 179.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.62 ' C ' ' O ' ' A' ' 68' ' ' VAL . 28.8 m -14.65 117.58 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.969 -178.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.775 HG21 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -114.06 -162.43 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 121.768 0.794 . . . . 0.0 111.996 -179.604 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.635 ' O ' ' CD2' ' A' ' 74' ' ' PHE . 9.2 mtm -21.25 143.17 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 113.855 -1.52 . . . . 0.0 112.716 -178.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 43.62 20.86 0.15 Allowed Glycine 0 N--CA 1.444 -0.791 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.768 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.467 ' O ' ' O ' ' A' ' 74' ' ' PHE . . . 81.55 27.94 45.42 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.055 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.635 ' CD2' ' O ' ' A' ' 71' ' ' MET . 38.5 m-85 -50.45 -174.51 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.69 0.281 . . . . 0.0 110.337 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.8 mttt -167.66 104.76 0.51 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.029 0.442 . . . . 0.0 112.057 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.176 HG21 ' CG2' ' A' ' 25' ' ' ILE . 16.8 m -98.13 14.8 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.36 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.392 178.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.898 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.8 OUTLIER 30.77 38.31 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 105.288 -2.115 . . . . 0.0 105.288 -176.869 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 1.013 ' HB2' HG13 ' A' ' 68' ' ' VAL . 30.4 t30 -2.52 66.88 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.974 0 CA-C-N 112.776 -2.011 . . . . 0.0 108.858 -174.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.818 ' O ' HD13 ' A' ' 26' ' ' LEU . 36.1 m170 -34.12 120.84 0.45 Allowed 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 113.349 -1.75 . . . . 0.0 112.405 -177.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.48 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.9 p -111.3 -14.25 13.82 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.368 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.786 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -165.08 138.86 4.8 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.1 OUTLIER -120.47 145.88 46.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.072 0.463 . . . . 0.0 111.5 -179.142 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.642 ' O ' HG23 ' A' ' 61' ' ' VAL . 0.6 OUTLIER -149.88 116.11 5.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.774 179.814 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 5.7 m -61.4 125.04 22.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.7 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.475 ' O ' ' SG ' ' A' ' 87' ' ' CYS . 8.0 m -162.3 -154.83 0.34 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.93 0.395 . . . . 0.0 111.081 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.461 ' C ' ' SG ' ' A' ' 87' ' ' CYS . 15.2 m -65.61 138.96 58.37 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.92 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.495 ' SG ' ' O ' ' A' ' 59' ' ' CYS . 0.1 OUTLIER -177.82 -179.61 0.8 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.726 179.891 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -45.06 123.92 4.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.989 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.525 ' O ' ' CD2' ' A' ' 90' ' ' HIS . 30.6 t80 -99.52 -67.76 0.84 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.54 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.525 ' CD2' ' O ' ' A' ' 89' ' ' TYR . 0.2 OUTLIER -177.04 17.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.112 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.431 ' O ' ' CB ' ' A' ' 92' ' ' SER . 0.0 OUTLIER -166.43 9.48 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.444 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.431 ' CB ' ' O ' ' A' ' 91' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.321 -0.847 . . . . 0.0 111.064 179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 1.143 ' H83' ' CB ' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.518 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . 0.441 ' H3 ' ' O7 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.578 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . 0.578 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . 0.542 ' O2 ' ' HA ' ' A' ' 21' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.825 0.345 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -63.15 167.44 12.54 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.917 2.411 . . . . 0.0 112.14 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -142.31 -40.02 0.35 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.917 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.8 HG13 ' HG2' ' A' ' 5' ' ' GLN . 0.3 OUTLIER -125.79 138.86 53.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.907 179.952 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.8 ' HG2' HG13 ' A' ' 4' ' ' VAL . 10.2 mm100 69.92 -166.52 0.17 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.018 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.443 ' C ' ' O ' ' A' ' 5' ' ' GLN . 70.3 m-20 35.53 71.0 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.575 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -131.05 127.47 22.01 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.861 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.436 ' O ' ' SG ' ' A' ' 31' ' ' CYS . 60.6 Cg_endo -73.44 167.22 27.84 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 122.572 2.181 . . . . 0.0 112.135 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.447 ' HA ' ' HE1' ' A' ' 33' ' ' PHE . 1.8 tt0 -63.97 160.03 18.69 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.294 0.569 . . . . 0.0 111.144 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.526 ' HA ' ' HA3' ' A' ' 30' ' ' GLY . 1.0 OUTLIER -91.05 112.39 24.28 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.842 -179.954 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.573 ' O ' ' N ' ' A' ' 29' ' ' MET . 11.7 t -177.9 -177.42 0.63 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.246 0.546 . . . . 0.0 111.041 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.169 HD21 ' O ' ' A' ' 79' ' ' HIS . 4.9 mp -64.04 131.28 47.12 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.716 -179.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.669 ' O ' ' O ' ' A' ' 14' ' ' GLU . 2.1 mt-30 -114.35 59.1 0.68 Allowed 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.253 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.669 ' O ' ' O ' ' A' ' 13' ' ' GLN . 31.5 tt0 4.56 125.26 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.327 -1.761 . . . . 0.0 112.231 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.913 ' ND2' HG11 ' A' ' 76' ' ' VAL . 9.1 t-20 -51.8 123.19 24.04 Favored Pre-proline 0 C--N 1.314 -0.937 0 CA-C-N 114.407 -1.269 . . . . 0.0 111.769 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -83.31 20.44 1.17 Allowed 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 122.692 2.261 . . . . 0.0 111.559 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.615 ' CD1' ' HB ' ' A' ' 70' ' ' VAL . 29.9 t80 -133.2 -52.55 0.9 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.449 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 1.095 ' CD1' HG12 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -77.2 -10.78 59.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.964 -179.647 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.587 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -61.82 83.64 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.002 0.429 . . . . 0.0 110.682 -179.789 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.639 ' HB3' ' HD2' ' A' ' 21' ' ' PRO . 1.1 mt-30 -110.83 164.76 14.1 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.696 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.639 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 27.3 Cg_endo -61.62 61.33 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.574 2.183 . . . . 0.0 111.544 179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 157.41 -15.31 0.32 Allowed Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.469 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 1.03 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -148.71 104.86 3.44 Favored Pre-proline 0 CA--C 1.514 -0.415 0 CA-C-O 121.905 0.86 . . . . 0.0 111.654 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.652 ' O ' ' O ' ' A' ' 25' ' ' ILE . 92.3 Cg_endo -105.37 67.39 0.02 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.455 0 C-N-CA 124.756 3.637 . . . . 0.0 113.379 -178.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.322 ' CG2' HG21 ' A' ' 76' ' ' VAL . 29.8 mm -41.87 -173.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.032 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.753 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.058 HD11 ' OD1' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -151.51 -157.72 0.84 Allowed 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -175.192 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.529 ' CG ' ' O ' ' A' ' 27' ' ' GLN . 3.8 tt0 169.44 66.12 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 112.895 -1.957 . . . . 0.0 111.321 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.662 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 17.0 t -23.78 99.35 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.7 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.573 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.3 OUTLIER -137.14 145.45 43.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.061 -179.654 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.526 ' HA3' ' HA ' ' A' ' 10' ' ' CYS . . . 162.47 -127.08 1.65 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.569 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.436 ' SG ' ' O ' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -154.57 133.49 12.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.89 0.376 . . . . 0.0 110.732 -179.84 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.53 ' O ' ' HB3' ' A' ' 33' ' ' PHE . 98.2 m -71.79 108.83 5.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.572 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.556 ' CD1' ' C ' ' A' ' 33' ' ' PHE . 0.0 OUTLIER 173.98 9.11 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.324 179.504 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.425 ' O ' ' O ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -45.71 124.4 5.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.84 0.352 . . . . 0.0 110.78 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.45 ' HD2' ' HA ' ' A' ' 35' ' ' ARG . 0.5 OUTLIER 58.17 151.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.711 -179.666 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.439 ' O ' ' O ' ' A' ' 35' ' ' ARG . . . 40.35 96.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.18 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.6 p90 -84.29 121.48 75.31 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 120.93 0.395 . . . . 0.0 110.638 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.52 ' O ' ' HD3' ' A' ' 40' ' ' PRO . 74.7 Cg_exo -48.26 -178.42 0.01 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.79 2.326 . . . . 0.0 112.126 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.603 ' HB ' HD11 ' A' ' 41' ' ' LEU . 18.4 p -104.66 80.63 0.48 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.807 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.52 ' HD3' ' O ' ' A' ' 38' ' ' PRO . 50.3 Cg_exo -40.46 -73.44 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.859 2.372 . . . . 0.0 112.409 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.603 HD11 ' HB ' ' A' ' 39' ' ' THR . 0.1 OUTLIER 32.21 54.32 0.32 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.059 -179.848 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.563 ' O ' ' CB ' ' A' ' 43' ' ' SER . 0.4 OUTLIER 73.0 127.86 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.702 -179.826 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.563 ' CB ' ' O ' ' A' ' 42' ' ' ARG . 3.4 t 87.98 135.75 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.653 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.2 mtpt -102.49 47.59 0.89 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.363 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.06 152.71 3.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.642 179.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.867 HG21 HE22 ' A' ' 50' ' ' GLN . 0.2 OUTLIER -50.01 150.99 2.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.72 179.922 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -84.3 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.176 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.534 ' H ' ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -58.2 -179.2 0.05 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.834 0.35 . . . . 0.0 110.861 -179.825 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.5 p -93.2 130.8 41.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.075 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.867 HE22 HG21 ' A' ' 46' ' ' THR . 0.0 OUTLIER 177.9 48.16 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.652 -179.78 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.447 ' C ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER 31.01 94.78 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.32 -179.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.436 ' C ' ' O ' ' A' ' 51' ' ' LYS . 5.5 p30 -33.35 133.62 0.15 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.948 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.41 HG22 ' N ' ' A' ' 54' ' ' THR . 12.1 p -139.09 155.28 26.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.242 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.41 ' N ' HG22 ' A' ' 53' ' ' VAL . 0.2 OUTLIER 48.48 47.09 20.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.949 179.797 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.0 m 46.85 -93.99 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.521 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.424 ' O ' ' CB ' ' A' ' 57' ' ' SER . 0.0 OUTLIER -91.09 -94.96 0.12 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.442 -179.285 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.479 ' OG ' ' N ' ' A' ' 58' ' ' THR . 2.0 p 77.17 -149.11 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.564 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.546 ' O ' ' CB ' ' A' ' 59' ' ' CYS . 0.2 OUTLIER 58.07 172.26 0.05 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.856 -179.885 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.546 ' CB ' ' O ' ' A' ' 58' ' ' THR . 0.7 OUTLIER 156.07 133.94 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.904 179.836 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 90.3 m -73.25 65.5 0.84 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.715 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.572 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -91.87 73.63 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.877 0.37 . . . . 0.0 111.358 -179.832 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.795 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 11.67 116.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.345 -0.843 . . . . 0.0 113.096 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.682 ' N ' ' O ' ' A' ' 81' ' ' ALA . 6.0 ttmm -54.53 -38.56 66.7 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 177.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.604 ' HB2' ' HB3' ' A' ' 81' ' ' ALA . 2.9 m -134.38 166.38 22.97 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.364 -1.289 . . . . 0.0 108.815 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.756 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 0.5 OUTLIER -151.4 159.28 44.32 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.165 -0.614 . . . . 0.0 112.491 -179.285 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.974 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -128.65 28.07 5.44 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 122.554 1.169 . . . . 0.0 107.903 176.798 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.612 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.5 OUTLIER -4.95 130.67 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 112.174 -2.285 . . . . 0.0 113.09 -179.496 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.943 HG11 ' CD1' ' A' ' 25' ' ' ILE . 1.6 m -144.57 46.79 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.243 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.796 HG23 ' C ' ' A' ' 73' ' ' GLY . 16.9 m -12.05 122.33 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.75 -1.113 . . . . 0.0 111.649 -179.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 1.095 HG12 ' CD1' ' A' ' 18' ' ' PHE . 3.7 m -119.03 -169.1 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.946 0.879 . . . . 0.0 112.759 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.758 ' HG2' HG23 ' A' ' 70' ' ' VAL . 0.4 OUTLIER 21.34 -120.57 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.02 -1.445 . . . . 0.0 112.529 179.917 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.405 ' H ' ' CG ' ' A' ' 71' ' ' MET . . . -70.75 31.66 0.49 Allowed Glycine 0 CA--C 1.518 0.231 0 CA-C-N 115.986 -0.552 . . . . 0.0 113.504 -178.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.796 ' C ' HG23 ' A' ' 69' ' ' THR . . . 90.85 22.1 34.34 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.685 -0.769 . . . . 0.0 111.756 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.786 ' HB2' HG22 ' A' ' 70' ' ' VAL . 0.6 OUTLIER -45.7 -178.95 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.091 0.472 . . . . 0.0 111.374 -179.887 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.558 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -154.66 82.33 1.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.369 179.543 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.322 HG21 ' CG2' ' A' ' 25' ' ' ILE . 27.2 m -78.38 12.25 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.493 -1.241 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.229 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.838 ' CG ' ' HE2' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 24.07 44.58 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 -178.364 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 1.058 ' OD1' HD11 ' A' ' 26' ' ' LEU . 31.3 t-20 6.36 63.36 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 -174.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 1.169 ' O ' HD21 ' A' ' 12' ' ' LEU . 32.2 m170 -37.98 108.79 0.09 Allowed 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.433 -176.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.559 HG23 ' O ' ' A' ' 78' ' ' ASN . 4.7 p -104.48 -5.14 21.89 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.012 -1.449 . . . . 0.0 110.702 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.682 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -162.06 144.32 11.33 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 179.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.591 ' SG ' ' CD1' ' A' ' 12' ' ' LEU . 84.5 m -121.13 157.56 29.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.062 0.458 . . . . 0.0 111.718 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.6 ' CD2' ' HA ' ' A' ' 63' ' ' LYS . 0.2 OUTLIER 176.39 118.12 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.377 179.628 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 34.5 m -51.57 131.48 29.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.413 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.518 ' O ' ' HB2' ' A' ' 59' ' ' CYS . 0.2 OUTLIER -171.77 145.93 2.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.507 179.738 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.498 ' C ' ' O ' ' A' ' 85' ' ' SER . 0.8 OUTLIER -29.16 142.99 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.009 -179.711 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.494 ' O ' ' C ' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -95.54 130.13 42.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.16 -179.688 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.593 ' O ' ' C ' ' A' ' 89' ' ' TYR . 0.1 OUTLIER -29.0 115.18 0.09 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.867 179.724 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.593 ' C ' ' O ' ' A' ' 88' ' ' TYR . 2.6 m-85 -12.51 -73.83 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.538 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.592 ' CD2' ' O ' ' A' ' 89' ' ' TYR . 0.7 OUTLIER 153.36 140.64 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.731 179.819 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -47.47 169.96 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.875 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.837 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 1.086 ' H82' HD11 ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.763 ' O7 ' ' C3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.662 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . 0.662 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.462 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.763 0.316 . . . . 0.0 110.954 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 1' ' ' ALA . 6.3 Cg_exo -77.26 -155.25 0.05 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 123.008 2.472 . . . . 0.0 112.304 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.28 111.67 3.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.868 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.0 m -90.86 168.12 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.132 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -148.83 177.52 9.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.762 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.561 ' OD1' ' N ' ' A' ' 6' ' ' ASP . 3.1 p-10 -129.66 -176.18 3.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.078 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.505 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.1 OUTLIER -25.53 103.13 0.12 Allowed Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.402 -179.925 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.44 ' O ' ' C ' ' A' ' 9' ' ' GLU . 72.6 Cg_endo -78.39 143.78 19.82 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.732 2.288 . . . . 0.0 112.104 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.526 ' O ' ' CG2' ' A' ' 11' ' ' THR . 0.0 OUTLIER -34.76 115.93 0.3 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.882 0.373 . . . . 0.0 110.626 179.876 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.466 ' O ' HG22 ' A' ' 11' ' ' THR . 7.2 t -49.94 136.87 17.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.204 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.846 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -161.96 -137.01 0.03 OUTLIER 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.973 179.325 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.168 HD21 ' O ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER -111.5 129.53 56.02 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.156 179.226 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.629 ' HG3' ' HB2' ' A' ' 29' ' ' MET . 1.2 mt-30 -103.01 48.15 0.86 Allowed 'General case' 0 CA--C 1.502 -0.899 0 CA-C-O 121.713 0.768 . . . . 0.0 110.846 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.611 ' C ' ' O ' ' A' ' 13' ' ' GLN . 39.4 tt0 -7.12 120.69 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.52 -1.673 . . . . 0.0 110.619 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.727 ' CB ' ' HB ' ' A' ' 25' ' ' ILE . 0.4 OUTLIER -54.46 98.95 0.19 Allowed Pre-proline 0 C--N 1.306 -1.318 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.98 -178.904 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.572 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 2.8 Cg_exo -73.84 6.0 3.12 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.464 2.109 . . . . 0.0 109.224 177.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.488 ' H ' ' C ' ' A' ' 15' ' ' ASN . 1.0 OUTLIER -101.27 -54.3 2.81 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 113.671 -1.604 . . . . 0.0 110.398 -179.673 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.885 ' CD2' HG21 ' A' ' 70' ' ' VAL . 0.4 OUTLIER -86.97 -21.77 25.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.879 -179.714 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.724 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 28.2 t -37.9 107.53 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.758 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.812 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -115.0 171.29 4.59 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.945 -179.692 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -65.63 70.29 0.34 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.855 2.37 . . . . 0.0 111.601 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 135.29 -5.79 4.24 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.197 -179.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 1.007 ' CB ' ' H83' ' A' ' 178' ' ' NAG . . . -151.37 102.72 2.93 Favored Pre-proline 0 CA--C 1.513 -0.459 0 CA-C-O 122.037 0.922 . . . . 0.0 111.526 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.724 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 88.6 Cg_endo -103.0 80.02 0.03 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.529 0 C-N-CA 124.788 3.659 . . . . 0.0 113.131 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.224 ' CG2' HG21 ' A' ' 76' ' ' VAL . 15.1 mm -40.8 -177.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.97 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.634 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.08 HD13 HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -152.04 -160.82 1.2 Allowed 'General case' 0 CA--C 1.498 -1.057 0 CA-C-O 122.681 1.229 . . . . 0.0 114.237 -175.624 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.527 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 4.7 tt0 159.98 62.21 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 112.348 -2.206 . . . . 0.0 110.324 179.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.753 ' SG ' ' HB3' ' A' ' 79' ' ' HIS . 75.9 m -23.35 118.69 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.275 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.629 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -150.1 130.07 13.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.003 0.43 . . . . 0.0 111.389 179.767 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 170.42 -112.88 0.48 Allowed Glycine 0 N--CA 1.452 -0.265 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.099 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -162.14 153.84 18.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.683 0.278 . . . . 0.0 110.589 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.511 ' HB2' ' HB3' ' A' ' 84' ' ' CYS . 6.1 t -114.55 80.64 1.43 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.874 0.369 . . . . 0.0 111.248 -179.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -117.07 -5.78 11.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.532 179.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 56.8 m -103.07 -164.9 1.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.705 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.526 ' NH2' ' O ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -176.97 44.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.252 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.41 ' C ' ' O ' ' A' ' 35' ' ' ARG . . . -38.23 92.66 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.68 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.556 ' HB3' ' HD3' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -89.6 -59.73 0.24 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.204 -179.633 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.556 ' HD3' ' HB3' ' A' ' 37' ' ' TYR . 83.1 Cg_endo -89.75 174.31 3.4 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.036 2.491 . . . . 0.0 112.875 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.618 ' OG1' ' HD2' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -121.72 163.08 33.21 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.312 179.687 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.618 ' HD2' ' OG1' ' A' ' 39' ' ' THR . 60.2 Cg_endo -82.93 53.3 4.33 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.498 2.132 . . . . 0.0 112.276 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.528 ' O ' ' HB3' ' A' ' 42' ' ' ARG . 5.2 mt -149.05 125.43 10.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.624 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.528 ' HB3' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER 70.34 -83.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.941 -179.736 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.89 43.81 0.61 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.945 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.78 93.44 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.958 0.408 . . . . 0.0 110.514 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.426 ' NZ ' ' HB3' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -169.35 151.48 4.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.725 -179.708 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 61.5 p -143.8 82.78 1.73 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.9 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.02 5.3 7.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.072 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.682 ' C ' HD22 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -81.32 76.26 8.26 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.94 0.4 . . . . 0.0 110.746 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.805 HG23 ' HG2' ' A' ' 50' ' ' GLN . 4.4 m -91.0 -151.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.192 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.805 ' HG2' HG23 ' A' ' 49' ' ' VAL . 0.8 OUTLIER 37.68 84.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.521 ' O ' ' CG ' ' A' ' 51' ' ' LYS . 37.1 tttt 166.5 53.96 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.573 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -175.26 118.39 0.17 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.115 -179.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 9.9 p -122.01 154.79 26.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.052 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.6 p -107.25 100.74 10.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.7 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.06 11.58 16.46 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.63 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 54.19 59.57 4.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.727 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.463 ' C ' ' OG1' ' A' ' 58' ' ' THR . 0.5 OUTLIER -139.31 -163.95 1.58 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.725 -179.841 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.491 HG22 ' CA ' ' A' ' 85' ' ' SER . 0.0 OUTLIER 63.44 164.35 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.989 179.935 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 17.3 p -162.4 142.0 9.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 65.6 m -81.66 102.31 10.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.7 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.515 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.1 OUTLIER -116.82 49.72 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 121.154 0.502 . . . . 0.0 111.288 -179.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.771 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 44.15 112.85 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.528 179.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.673 ' HB3' ' CB ' ' A' ' 81' ' ' ALA . 19.5 ttmt -56.12 -36.69 68.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.589 0.709 . . . . 0.0 109.243 178.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.552 ' O ' ' N ' ' A' ' 80' ' ' THR . 18.5 m -147.09 135.17 21.5 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.752 -1.113 . . . . 0.0 108.62 179.249 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.726 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.3 OUTLIER -119.29 155.27 32.11 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.235 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.95 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -128.91 26.71 5.51 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 176.289 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.692 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.5 OUTLIER -4.91 127.62 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 112.58 -2.1 . . . . 0.0 111.769 -179.529 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.98 HG21 ' CD1' ' A' ' 25' ' ' ILE . 2.4 m -128.09 42.43 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.837 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.673 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 73.4 m -19.04 118.2 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.598 -179.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.885 HG21 ' CD2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -129.87 -167.5 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.732 179.741 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.611 ' HG3' ' CD2' ' A' ' 74' ' ' PHE . 0.2 OUTLIER 37.04 -137.94 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.342 -179.701 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -80.35 30.63 2.44 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.308 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.66 47.09 0.99 Allowed Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.336 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.673 ' O ' ' HA ' ' A' ' 69' ' ' THR . 9.2 m-30 -90.47 113.42 25.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.844 0.354 . . . . 0.0 110.904 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.597 ' HB3' ' OE1' ' A' ' 77' ' ' GLU . 1.9 mmmm -99.44 107.61 19.87 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.129 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.224 HG21 ' CG2' ' A' ' 25' ' ' ILE . 11.8 m -97.24 15.84 2.98 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.499 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.43 178.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.726 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 25.03 41.97 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.132 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -177.344 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.991 ' C ' HD12 ' A' ' 26' ' ' LEU . 10.9 t-20 9.19 65.58 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.998 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 -175.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 1.168 ' O ' HD21 ' A' ' 12' ' ' LEU . 25.6 m170 -42.27 89.73 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 122.455 1.122 . . . . 0.0 111.977 -175.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.716 HG22 ' OD1' ' A' ' 78' ' ' ASN . 4.2 p -79.88 -1.33 38.68 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 113.712 -1.585 . . . . 0.0 110.408 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.673 ' CB ' ' HB3' ' A' ' 63' ' ' LYS . . . -177.17 147.05 0.53 Allowed 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.826 ' SG ' HD12 ' A' ' 12' ' ' LEU . 2.7 m -116.15 164.94 13.74 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.875 0.369 . . . . 0.0 111.178 -179.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.554 ' CD2' ' HA ' ' A' ' 63' ' ' LYS . 1.9 p80 178.85 122.05 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.941 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.511 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 28.7 p -76.26 123.86 26.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.993 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.491 ' CA ' HG22 ' A' ' 58' ' ' THR . 4.4 t -147.71 135.91 21.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.17 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.417 ' HA ' ' HA ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -54.66 113.35 1.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.781 179.889 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.419 ' O ' ' C ' ' A' ' 88' ' ' TYR . 5.1 p -114.26 138.71 50.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.808 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.631 ' N ' ' CD1' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -34.03 146.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.043 179.947 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -157.28 76.25 0.83 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.978 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 29.0 m80 -147.75 171.14 16.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.476 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.412 ' C ' ' OG ' ' A' ' 92' ' ' SER . 2.5 mmtp -116.02 -160.9 0.77 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.859 0.361 . . . . 0.0 111.076 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.412 ' OG ' ' C ' ' A' ' 91' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.2 -0.905 . . . . 0.0 111.002 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 1.007 ' H83' ' CB ' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.568 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . 0.428 ' H62' ' H2 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . 0.428 ' H2 ' ' H62' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.598 ' O7 ' ' O3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.57 ' HB3' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.877 0.37 . . . . 0.0 111.003 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.57 ' HD3' ' HB3' ' A' ' 1' ' ' ALA . 18.6 Cg_endo -60.2 77.13 0.06 OUTLIER 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.711 2.274 . . . . 0.0 111.945 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.425 ' N ' ' O ' ' A' ' 1' ' ' ALA . 0.4 OUTLIER -123.96 120.46 32.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.096 -179.755 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.1 m -131.8 165.94 30.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.04 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.494 ' O ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -161.96 120.4 2.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.804 0.335 . . . . 0.0 111.574 -179.754 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.587 ' O ' ' C ' ' A' ' 7' ' ' CYS . 1.1 m-20 35.43 -161.03 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.352 179.298 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.587 ' C ' ' O ' ' A' ' 6' ' ' ASP . 4.9 t -3.8 89.33 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.296 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.165 -179.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.605 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 93.3 Cg_endo -81.96 39.99 0.92 Allowed 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.909 2.406 . . . . 0.0 111.935 179.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.703 ' O ' HG22 ' A' ' 11' ' ' THR . 0.0 OUTLIER 95.19 141.91 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.927 -179.723 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.473 ' HA ' ' HA3' ' A' ' 30' ' ' GLY . 0.0 OUTLIER -38.78 137.54 0.63 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.96 180.0 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.703 HG22 ' O ' ' A' ' 9' ' ' GLU . 2.7 t 174.98 -165.57 0.03 OUTLIER 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 120.953 0.406 . . . . 0.0 110.611 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.999 HD23 HD13 ' A' ' 26' ' ' LEU . 6.5 mp -90.12 136.9 32.77 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.042 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.609 ' O ' ' O ' ' A' ' 14' ' ' GLU . 4.9 mt-30 -108.98 55.11 0.64 Allowed 'General case' 0 CA--C 1.503 -0.863 0 CA-C-O 121.739 0.781 . . . . 0.0 110.55 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.609 ' O ' ' O ' ' A' ' 13' ' ' GLN . 26.8 tt0 -1.13 122.12 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 113.419 -1.719 . . . . 0.0 111.203 -179.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.752 ' HB2' HG22 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -50.49 98.5 0.18 Allowed Pre-proline 0 C--N 1.304 -1.371 0 CA-C-N 114.154 -1.385 . . . . 0.0 111.904 -179.201 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.52 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 7.0 Cg_exo -71.8 20.45 0.27 Allowed 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 122.373 2.049 . . . . 0.0 109.592 177.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.628 ' H ' ' C ' ' A' ' 15' ' ' ASN . 1.5 t80 -125.1 -55.8 1.57 Allowed 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.157 -178.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.729 ' CD2' HG21 ' A' ' 70' ' ' VAL . 2.0 m-30 -83.12 -6.17 59.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.173 -179.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.707 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 6.1 t -60.45 83.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.769 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.79 ' O ' ' N ' ' A' ' 22' ' ' GLY . 9.0 mm100 -97.66 145.03 29.01 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.802 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -44.12 69.96 0.01 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.736 2.29 . . . . 0.0 111.459 179.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.79 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 153.06 -20.2 0.75 Allowed Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.126 -179.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 1.053 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -150.44 108.64 3.15 Favored Pre-proline 0 CA--C 1.515 -0.382 0 CA-C-O 121.892 0.853 . . . . 0.0 111.519 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.707 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 62.9 Cg_endo -101.74 73.06 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.35 0 C-N-CA 124.705 3.603 . . . . 0.0 113.22 -178.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.161 ' CG2' HG21 ' A' ' 76' ' ' VAL . 6.9 mm -40.63 -176.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 N-CA-C 113.483 0.919 . . . . 0.0 113.483 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.073 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER -150.21 -162.48 1.56 Allowed 'General case' 0 CA--C 1.502 -0.888 0 CA-C-O 122.635 1.207 . . . . 0.0 114.175 -175.692 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.531 ' O ' ' C ' ' A' ' 28' ' ' CYS . 10.6 tt0 164.2 77.67 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 112.661 -2.063 . . . . 0.0 110.903 179.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.622 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER -19.21 114.65 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.28 -179.568 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.544 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.8 mtp -154.1 109.25 3.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.799 0.333 . . . . 0.0 111.204 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.473 ' HA3' ' HA ' ' A' ' 10' ' ' CYS . . . -172.53 -146.67 5.48 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.634 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.511 ' N ' ' SG ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -148.51 115.26 6.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.765 0.316 . . . . 0.0 110.862 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -52.66 122.98 10.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.89 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -85.15 164.34 18.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.997 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -113.8 -152.19 0.5 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.778 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.74 35.86 4.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.982 0.42 . . . . 0.0 110.881 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.81 177.47 2.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.069 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.415 ' O ' ' C ' ' A' ' 38' ' ' PRO . 2.1 p90 -153.48 153.81 29.66 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.811 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.415 ' C ' ' O ' ' A' ' 37' ' ' TYR . 51.4 Cg_exo -32.08 123.72 0.1 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 123.021 2.48 . . . . 0.0 112.056 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.744 HG22 ' O ' ' A' ' 39' ' ' THR . 23.0 m -123.08 61.12 17.21 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.378 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.531 ' O ' ' N ' ' A' ' 42' ' ' ARG . 61.2 Cg_endo -72.81 -35.65 5.46 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.712 2.274 . . . . 0.0 112.102 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.541 ' O ' ' HB2' ' A' ' 42' ' ' ARG . 4.8 mt 34.13 -89.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.468 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.541 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 1.2 mtp85 71.02 31.6 2.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.753 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.7 p -137.67 -93.26 0.21 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.098 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.405 ' HE3' ' HB2' ' A' ' 44' ' ' LYS . 0.8 OUTLIER -140.21 121.76 15.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.672 -179.805 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 5.9 mmtp -51.38 -177.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.621 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.446 ' O ' ' C ' ' A' ' 47' ' ' MET . 0.9 OUTLIER -123.36 -44.46 2.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.417 -179.645 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.555 ' CG ' ' O ' ' A' ' 47' ' ' MET . 0.0 OUTLIER 34.91 69.61 0.16 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.855 0.359 . . . . 0.0 110.539 -179.407 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.7 -169.47 1.62 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.958 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -85.74 165.06 2.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.874 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 57.38 22.81 8.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.617 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -155.57 76.18 0.94 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.956 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -162.09 25.97 0.11 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.739 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.77 155.63 30.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.27 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.23 -177.97 3.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.891 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.9 m -121.09 87.56 2.78 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.852 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.442 ' O ' ' CB ' ' A' ' 57' ' ' SER . 0.3 OUTLIER -121.58 -177.8 3.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.261 -179.976 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.442 ' CB ' ' O ' ' A' ' 56' ' ' GLU . 0.3 OUTLIER 79.94 -1.14 2.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.542 -179.557 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.495 ' HB ' ' SG ' ' A' ' 84' ' ' CYS . 0.6 OUTLIER -67.2 140.88 57.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.647 179.733 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.555 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 0.7 OUTLIER -145.54 137.1 25.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.172 -179.852 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.704 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -119.82 54.95 0.99 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.391 -179.809 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.561 ' O ' ' C ' ' A' ' 62' ' ' ALA . 6.0 t -56.17 85.01 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.66 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.581 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 7.65 111.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.589 -179.747 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.762 ' N ' ' O ' ' A' ' 81' ' ' ALA . 6.2 tptp -55.2 -39.23 69.39 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.73 0.776 . . . . 0.0 109.377 178.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.515 ' HB3' ' OG1' ' A' ' 80' ' ' THR . 0.7 OUTLIER -147.41 133.12 18.89 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.353 179.56 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.669 ' HB2' ' C ' ' A' ' 77' ' ' GLU . 1.6 p90 -115.91 169.54 9.16 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 121.879 0.847 . . . . 0.0 112.527 -178.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.772 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.7 OUTLIER -131.45 27.5 4.72 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 113.888 -1.506 . . . . 0.0 107.133 176.104 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.549 ' HA ' ' CA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -4.99 92.6 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.15 -2.296 . . . . 0.0 111.319 -179.736 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.932 HG11 HD11 ' A' ' 25' ' ' ILE . 30.1 t -94.14 71.68 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.401 0 CA-C-N 113.213 -1.812 . . . . 0.0 111.089 -179.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.68 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 99.6 m -54.09 117.72 3.46 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.174 0.511 . . . . 0.0 110.441 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.729 HG21 ' CD2' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -128.13 -166.64 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.849 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.683 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 1.5 mmm 35.89 -135.42 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.53 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -82.16 30.33 3.01 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.357 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 106.33 53.9 0.72 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.545 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.683 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 4.0 m-85 -100.42 112.88 25.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.747 0.308 . . . . 0.0 111.047 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.482 ' O ' ' OE2' ' A' ' 77' ' ' GLU . 19.0 mtpt -99.94 108.98 21.35 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.287 0.565 . . . . 0.0 111.433 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.161 HG21 ' CG2' ' A' ' 25' ' ' ILE . 15.8 m -94.76 18.0 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.486 -1.483 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.667 179.163 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.84 ' O ' ' HD2' ' A' ' 79' ' ' HIS . 0.4 OUTLIER 29.77 39.12 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 -176.099 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.924 ' HB2' HG23 ' A' ' 68' ' ' VAL . 38.3 t30 -8.02 70.08 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 113.332 -1.758 . . . . 0.0 108.582 -174.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 1.073 ' N ' HD12 ' A' ' 26' ' ' LEU . 42.5 m170 -40.5 118.04 0.89 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 112.958 -1.928 . . . . 0.0 114.246 -176.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.515 ' OG1' ' HB3' ' A' ' 64' ' ' SER . 2.3 p -103.46 -7.78 20.66 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 113.481 -1.69 . . . . 0.0 109.888 178.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.762 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -174.38 140.46 0.65 Allowed 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.543 179.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.642 ' SG ' HD11 ' A' ' 12' ' ' LEU . 1.3 m -128.54 121.56 29.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.714 0.292 . . . . 0.0 110.268 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.704 ' O ' ' HA ' ' A' ' 60' ' ' CYS . 0.6 OUTLIER -109.85 105.27 14.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.088 0.47 . . . . 0.0 111.677 -179.359 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.555 ' HA ' ' O ' ' A' ' 59' ' ' CYS . 4.6 t -77.16 153.74 33.86 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.729 179.392 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.518 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 0.7 OUTLIER 84.32 40.32 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.931 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.734 ' O ' HG23 ' A' ' 86' ' ' THR . 1.3 t -115.24 38.64 3.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.858 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 57' ' ' SER . 94.5 m -137.93 54.7 1.79 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.057 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 20.2 m-30 51.06 -175.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.194 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 61.56 97.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.245 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -129.87 -15.89 3.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.114 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.5 tttt -95.75 121.37 37.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.769 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.812 179.802 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 1.053 ' H83' ' HB1' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.76 ' O7 ' ' C3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . 0.876 ' H62' ' H5 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . 0.59 ' C5 ' ' H2 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . 0.876 ' H5 ' ' H62' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . 0.455 ' H3 ' ' O7 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.564 ' O7 ' ' O2 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . 0.41 ' H2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.586 ' HB3' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 120.972 0.415 . . . . 0.0 111.035 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.586 ' HD3' ' HB3' ' A' ' 1' ' ' ALA . 32.3 Cg_exo -57.96 149.7 68.81 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.824 2.35 . . . . 0.0 112.243 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.464 ' O ' ' N ' ' A' ' 5' ' ' GLN . 0.5 OUTLIER -77.33 149.43 35.29 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.901 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.44 HG22 ' O ' ' A' ' 4' ' ' VAL . 8.9 p 37.81 29.0 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.216 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.499 ' HB3' ' HB2' ' A' ' 2' ' ' PRO . 1.7 tp-100 -132.76 78.82 1.81 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.764 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' A' ' 5' ' ' GLN . 2.8 m-20 80.64 -173.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.86 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.42 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -96.12 130.22 31.76 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.991 -179.819 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 7' ' ' CYS . 14.9 Cg_exo -68.22 88.55 0.39 Allowed 'Trans proline' 0 C--O 1.23 0.125 0 C-N-CA 122.843 2.362 . . . . 0.0 112.125 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.521 ' HA ' ' O ' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -45.89 106.03 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.977 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.514 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER 23.15 87.81 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.087 179.921 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.766 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 2.9 t -150.87 -166.77 2.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.263 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.044 HD23 HD13 ' A' ' 26' ' ' LEU . 4.2 mp -100.86 138.87 37.34 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.085 0.469 . . . . 0.0 111.189 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.653 ' CG ' ' HB2' ' A' ' 29' ' ' MET . 2.4 mt-30 -108.92 58.67 0.6 Allowed 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.209 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.641 ' HG3' ' O ' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -4.12 122.28 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 114.03 -1.441 . . . . 0.0 111.469 -179.429 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.911 ' ND2' HG11 ' A' ' 76' ' ' VAL . 5.3 t-20 -54.92 117.93 15.66 Favored Pre-proline 0 C--N 1.311 -1.105 0 CA-C-N 114.689 -1.141 . . . . 0.0 111.939 -179.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -81.16 14.62 2.06 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.682 2.254 . . . . 0.0 111.556 179.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.471 ' CD2' ' SD ' ' A' ' 71' ' ' MET . 22.9 t80 -119.46 -55.74 2.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.146 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.841 ' CD2' HG13 ' A' ' 70' ' ' VAL . 0.7 OUTLIER -72.83 -10.67 60.06 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.152 -179.712 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.63 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 11.0 p -58.2 98.31 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.409 -179.55 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.639 ' O ' ' N ' ' A' ' 22' ' ' GLY . 6.1 mt-30 -121.96 152.76 60.14 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.905 178.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -45.28 75.79 0.01 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.178 0 C-N-CA 122.734 2.29 . . . . 0.0 112.638 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.639 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 127.86 2.76 6.09 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.556 -0.831 . . . . 0.0 113.269 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 1.033 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -160.19 98.17 1.46 Allowed Pre-proline 0 CA--C 1.514 -0.432 0 CA-C-O 122.084 0.945 . . . . 0.0 111.769 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.63 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 98.6 Cg_endo -107.73 81.7 0.02 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.575 0 C-N-CA 125.235 3.956 . . . . 0.0 113.5 -178.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.295 ' CG2' HG21 ' A' ' 76' ' ' VAL . 23.0 mm -44.75 -177.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.048 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -147.56 -158.79 0.95 Allowed 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 -175.386 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.519 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 6.9 tm0? 161.85 94.85 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 112.431 -2.168 . . . . 0.0 109.601 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.766 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -36.01 110.71 0.11 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.9 -178.292 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.658 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.1 tpt -44.27 -78.08 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.938 0.399 . . . . 0.0 110.068 178.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 110.98 55.27 0.51 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.725 -0.75 . . . . 0.0 113.118 179.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.521 ' O ' ' HA ' ' A' ' 9' ' ' GLU . 16.7 t -124.96 62.68 1.15 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.944 0.402 . . . . 0.0 110.308 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.47 ' O ' ' O ' ' A' ' 33' ' ' PHE . 0.1 OUTLIER -80.71 23.51 0.53 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.018 -179.19 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.488 ' O ' ' HB3' ' A' ' 34' ' ' SER . 89.3 m-85 55.71 158.34 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.86 0.362 . . . . 0.0 110.771 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.497 ' O ' ' OG ' ' A' ' 34' ' ' SER . 1.0 OUTLIER 173.22 44.96 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.538 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.494 ' CB ' ' O ' ' A' ' 34' ' ' SER . 0.1 OUTLIER 84.97 -167.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.794 -179.844 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -112.92 117.42 32.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.068 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.489 ' C ' ' CD1' ' A' ' 37' ' ' TYR . 0.9 OUTLIER 46.92 87.34 0.12 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.805 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 37' ' ' TYR . 2.2 Cg_endo -41.24 133.98 3.0 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 122.597 2.198 . . . . 0.0 111.546 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.668 ' HB ' ' HD3' ' A' ' 40' ' ' PRO . 1.4 m -148.33 -64.7 0.02 OUTLIER Pre-proline 0 C--N 1.327 -0.408 0 CA-C-O 121.492 0.663 . . . . 0.0 111.339 -179.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.668 ' HD3' ' HB ' ' A' ' 39' ' ' THR . 39.2 Cg_endo -68.71 81.63 0.58 Allowed 'Trans proline' 0 C--N 1.325 -0.674 0 C-N-CA 123.693 2.928 . . . . 0.0 112.306 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.56 HD13 ' O ' ' A' ' 39' ' ' THR . 2.6 mp -90.05 -43.01 10.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.006 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.544 ' C ' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -18.35 130.06 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.622 -179.696 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 41' ' ' LEU . 0.1 OUTLIER -178.12 67.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.698 -179.891 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.51 -28.56 56.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.897 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.57 73.35 1.43 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.896 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.475 ' O ' ' C ' ' A' ' 47' ' ' MET . 0.2 OUTLIER -88.76 -23.86 22.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.702 179.966 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.475 ' C ' ' O ' ' A' ' 46' ' ' THR . 0.0 OUTLIER 29.52 90.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.999 179.797 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 48' ' ' LEU . 0.9 OUTLIER -88.43 126.31 35.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.304 0.573 . . . . 0.0 111.045 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.709 HG13 ' O ' ' A' ' 49' ' ' VAL . 0.5 OUTLIER 172.75 8.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.92 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.533 ' O ' ' CB ' ' A' ' 51' ' ' LYS . 38.1 mm-40 -134.2 156.73 47.85 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.106 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.533 ' CB ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER 84.73 146.79 0.07 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.877 0.37 . . . . 0.0 110.573 -179.721 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.566 ' O ' ' O ' ' A' ' 53' ' ' VAL . 3.4 p30 -72.87 153.66 40.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.427 -179.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.566 ' O ' ' O ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER 23.47 106.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.2 179.652 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -92.85 -58.68 2.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.835 179.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 25.6 p 45.61 76.43 0.09 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.173 179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -102.85 19.18 19.83 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.957 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.7 t -157.23 76.49 0.84 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.072 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.503 ' O ' ' HB3' ' A' ' 59' ' ' CYS . 7.2 p -71.33 163.03 28.45 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.931 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.52 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 0.8 OUTLIER 176.09 123.65 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.979 0.419 . . . . 0.0 111.927 179.868 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.605 ' O ' ' N ' ' A' ' 62' ' ' ALA . 5.3 p -113.28 43.59 1.71 Allowed 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.628 178.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.657 ' O ' HG23 ' A' ' 61' ' ' VAL . 30.9 m -58.15 75.34 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.08 179.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.715 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 18.08 103.89 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.656 -178.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.986 ' HB2' ' CD2' ' A' ' 83' ' ' HIS . 6.5 tppt? -52.84 -31.82 41.22 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 121.971 0.891 . . . . 0.0 108.858 178.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.593 ' HB3' ' OG1' ' A' ' 80' ' ' THR . 3.7 t -144.21 152.05 40.33 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 113.806 -1.543 . . . . 0.0 108.535 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.656 ' CG ' ' CG ' ' A' ' 77' ' ' GLU . 1.8 p90 -135.69 164.83 26.98 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.575 0.702 . . . . 0.0 112.093 -179.272 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.674 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 6.6 t-20 -134.66 26.36 3.7 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 122.76 1.267 . . . . 0.0 108.42 177.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.696 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -9.95 132.09 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 112.007 -2.36 . . . . 0.0 112.371 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.979 HG21 HG13 ' A' ' 25' ' ' ILE . 2.2 m -140.02 44.19 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.873 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.683 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 45.5 m -10.3 119.1 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.888 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.841 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -116.58 -168.68 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.577 0.704 . . . . 0.0 112.082 179.748 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.66 ' HG3' ' CG ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER 27.96 -139.33 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.581 -1.19 . . . . 0.0 110.954 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -69.5 10.21 2.14 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.614 179.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.463 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 129.26 55.58 0.1 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.986 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.683 ' O ' ' HA ' ' A' ' 69' ' ' THR . 2.0 m-85 -95.33 108.57 20.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.988 0.423 . . . . 0.0 111.051 -179.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.479 ' HG2' ' OG1' ' A' ' 69' ' ' THR . 5.3 mtpt -96.44 100.26 11.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.369 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.295 HG21 ' CG2' ' A' ' 25' ' ' ILE . 22.6 m -87.38 11.8 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.339 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.307 179.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.748 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 30.68 39.11 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 -177.094 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.726 ' HB2' HG13 ' A' ' 68' ' ' VAL . 52.3 t30 -3.68 67.45 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 112.98 -1.918 . . . . 0.0 109.092 -174.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 1.048 ' N ' HD12 ' A' ' 26' ' ' LEU . 42.3 m170 -37.18 119.45 0.68 Allowed 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 112.802 -1.999 . . . . 0.0 114.362 -176.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.593 ' OG1' ' HB3' ' A' ' 64' ' ' SER . 0.7 OUTLIER -108.95 -7.37 15.42 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 113.552 -1.658 . . . . 0.0 109.926 178.136 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.973 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -168.91 122.08 0.81 Allowed 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.98 178.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.488 ' SG ' HD11 ' A' ' 12' ' ' LEU . 1.3 m -119.11 120.09 36.12 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.986 ' CD2' ' HB2' ' A' ' 63' ' ' LYS . 5.5 m170 -123.69 117.9 26.03 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.1 0.476 . . . . 0.0 112.237 -178.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.552 ' O ' ' HB2' ' A' ' 85' ' ' SER . 0.5 OUTLIER -79.54 122.42 26.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.239 179.792 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.552 ' HB2' ' O ' ' A' ' 84' ' ' CYS . 24.0 t 162.48 151.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.629 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.437 ' C ' ' O ' ' A' ' 85' ' ' SER . 3.7 m -36.48 133.57 0.52 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.798 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -124.25 163.83 20.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.628 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.513 ' O ' ' C ' ' A' ' 89' ' ' TYR . 0.1 OUTLIER -179.83 47.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.131 179.933 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.513 ' C ' ' O ' ' A' ' 88' ' ' TYR . 3.2 m-85 24.88 85.95 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.244 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.617 ' O ' ' C ' ' A' ' 91' ' ' LYS . 7.3 p-80 -90.18 -33.48 16.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.906 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.617 ' C ' ' O ' ' A' ' 90' ' ' HIS . 3.3 tttm 6.06 70.25 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.519 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.473 ' N ' ' O ' ' A' ' 90' ' ' HIS . 38.5 t . . . . . 0 C--O 1.247 0.966 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.876 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 1.033 ' H83' ' HB1' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . 0.516 ' C6 ' ' O5 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.863 ' H3 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . 0.863 ' O2 ' ' H3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . 0.516 ' O5 ' ' C6 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.991 0.424 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -84.23 117.55 2.18 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 123.01 2.473 . . . . 0.0 112.725 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -125.07 -85.94 0.63 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.758 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.437 HG22 ' H ' ' A' ' 4' ' ' VAL . 0.8 OUTLIER -59.15 160.87 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.029 179.915 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.535 ' O ' ' CB ' ' A' ' 6' ' ' ASP . 0.2 OUTLIER -91.99 -165.44 1.35 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.93 179.929 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.535 ' CB ' ' O ' ' A' ' 5' ' ' GLN . 5.7 t0 86.74 -147.28 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.605 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 45.9 t -156.12 129.35 4.43 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.808 0.337 . . . . 0.0 111.038 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -51.66 165.54 0.71 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.696 2.264 . . . . 0.0 112.343 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.562 ' CG ' ' CZ ' ' A' ' 33' ' ' PHE . 0.5 OUTLIER -67.08 119.29 11.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.738 179.799 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.699 ' HB2' ' N ' ' A' ' 32' ' ' CYS . 1.8 t -59.21 100.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.168 -179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.489 ' O ' ' N ' ' A' ' 29' ' ' MET . 0.0 OUTLIER -162.76 164.72 26.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.92 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.087 ' CD2' HD13 ' A' ' 26' ' ' LEU . 1.4 mp -60.35 124.25 19.76 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.654 ' HG3' ' CB ' ' A' ' 29' ' ' MET . 0.7 OUTLIER -116.67 60.52 0.74 Allowed 'General case' 0 CA--C 1.502 -0.867 0 CA-C-O 122.044 0.925 . . . . 0.0 111.723 -179.257 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.684 ' CD ' ' HB2' ' A' ' 24' ' ' PRO . 33.3 tt0 3.92 120.42 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 112.949 -1.932 . . . . 0.0 111.459 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.75 ' ND2' HG11 ' A' ' 76' ' ' VAL . 0.5 OUTLIER -53.89 100.74 0.23 Allowed Pre-proline 0 C--N 1.307 -1.264 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.562 -179.608 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.616 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 56.8 Cg_endo -69.98 5.4 1.8 Allowed 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 121.702 1.602 . . . . 0.0 109.951 178.054 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.597 ' CZ ' ' SD ' ' A' ' 71' ' ' MET . 0.3 OUTLIER -101.47 -60.64 1.49 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 113.992 -1.458 . . . . 0.0 110.847 -179.779 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.914 ' CD2' HG21 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -82.67 -2.17 53.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.651 -179.576 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.629 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -59.27 83.77 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.598 179.647 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.56 ' O ' ' N ' ' A' ' 22' ' ' GLY . 4.2 mt-30 -92.94 164.88 20.09 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.407 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.16 59.22 0.17 Allowed 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 122.527 2.151 . . . . 0.0 111.174 179.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.56 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 154.7 -14.93 0.53 Allowed Glycine 0 N--CA 1.449 -0.461 0 CA-C-N 115.716 -0.674 . . . . 0.0 112.549 -179.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.969 ' HB1' ' C8 ' ' A' ' 178' ' ' NAG . . . -142.52 105.16 5.45 Favored Pre-proline 0 CA--C 1.513 -0.448 0 CA-C-O 121.916 0.865 . . . . 0.0 111.374 -179.588 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.72 ' HD2' ' H3 ' ' A' ' 178' ' ' NAG . 71.9 Cg_endo -104.05 75.93 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.391 0 C-N-CA 124.687 3.592 . . . . 0.0 114.358 -177.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.275 ' CG2' HG21 ' A' ' 76' ' ' VAL . 15.2 mm -44.17 -175.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 178.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.087 HD13 ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -148.65 -161.19 1.29 Allowed 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -176.879 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.652 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 20.8 tt0 161.79 82.91 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 112.421 -2.172 . . . . 0.0 110.822 179.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 1.3 m -35.06 101.83 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.774 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.654 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -110.33 143.91 39.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.889 0.376 . . . . 0.0 111.225 179.796 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.592 ' HA3' ' HA ' ' A' ' 10' ' ' CYS . . . 131.89 -159.08 23.14 Favored Glycine 0 C--N 1.33 0.23 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.445 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.508 ' O ' ' O ' ' A' ' 32' ' ' CYS . 90.8 m -148.93 91.0 1.81 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.802 0.334 . . . . 0.0 111.039 -179.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.699 ' N ' ' HB2' ' A' ' 10' ' ' CYS . 0.1 OUTLIER 31.27 -154.68 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.058 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.562 ' CZ ' ' CG ' ' A' ' 9' ' ' GLU . 2.5 m-85 -131.54 167.78 18.8 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.821 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.542 ' O ' ' N ' ' A' ' 36' ' ' ALA . 1.2 m -108.1 -139.07 0.37 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.978 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 35' ' ' ARG . 0.7 OUTLIER -62.05 66.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.209 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.542 ' N ' ' O ' ' A' ' 34' ' ' SER . . . -65.74 123.98 21.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.153 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.531 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.5 OUTLIER 86.41 90.73 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.058 179.887 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.503 ' O ' HG22 ' A' ' 39' ' ' THR . 10.6 Cg_exo -70.57 -149.85 0.03 OUTLIER 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.916 2.41 . . . . 0.0 112.269 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.556 ' O ' ' CG2' ' A' ' 39' ' ' THR . 0.4 OUTLIER 80.12 111.26 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.757 -179.941 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -65.04 163.85 27.17 Favored 'Trans proline' 0 N--CA 1.465 -0.184 0 C-N-CA 122.791 2.327 . . . . 0.0 112.086 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -137.33 -173.09 3.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.89 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.56 ' CZ ' ' HB2' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -163.66 137.51 5.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.618 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.469 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 11.0 t 65.98 90.71 0.09 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.832 0.349 . . . . 0.0 110.59 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.74 24.43 4.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 -179.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.412 ' C ' ' OG1' ' A' ' 46' ' ' THR . 0.0 OUTLIER -56.92 -21.08 27.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.006 -179.924 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.701 ' O ' ' CB ' ' A' ' 47' ' ' MET . 0.0 OUTLIER 176.48 108.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.708 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.701 ' CB ' ' O ' ' A' ' 46' ' ' THR . 2.2 tmm? 126.68 89.08 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.429 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 48' ' ' LEU . 1.1 pt? -151.64 30.29 0.59 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.559 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 0.1 OUTLIER -31.6 112.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.089 179.938 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.582 ' O ' ' CB ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER 82.6 179.75 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.919 -179.88 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.582 ' CB ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER 95.49 176.69 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.006 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.469 ' HB2' ' O ' ' A' ' 51' ' ' LYS . 0.8 OUTLIER 79.3 51.12 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.641 -179.812 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.634 ' O ' ' CB ' ' A' ' 54' ' ' THR . 0.1 OUTLIER -150.6 167.48 2.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.278 -179.652 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.634 ' CB ' ' O ' ' A' ' 53' ' ' VAL . 1.7 m 143.16 153.33 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.608 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.466 ' HB2' ' O ' ' A' ' 54' ' ' THR . 9.8 m 77.49 151.89 0.13 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.958 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 25.8 pt-20 -43.56 145.4 0.63 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.997 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 169.66 -94.78 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.552 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.429 ' HA ' ' O ' ' A' ' 85' ' ' SER . 0.0 OUTLIER -49.1 166.79 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.457 -179.482 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.555 ' N ' ' O ' ' A' ' 85' ' ' SER . 35.1 m -151.0 132.92 15.1 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.01 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.7 m -82.06 101.14 10.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.209 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.598 ' O ' HG13 ' A' ' 61' ' ' VAL . 7.1 p -111.65 70.92 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.739 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.587 ' C ' ' O ' ' A' ' 61' ' ' VAL . . . 9.11 107.31 0.0 OUTLIER 'General case' 0 C--O 1.231 0.103 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.164 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.882 ' N ' ' O ' ' A' ' 81' ' ' ALA . 2.4 ttmm -55.35 -39.3 69.89 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.652 0.739 . . . . 0.0 109.372 178.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.513 ' N ' ' HB3' ' A' ' 81' ' ' ALA . 2.4 m -144.13 135.03 25.23 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.108 179.362 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.868 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.2 OUTLIER -119.45 160.59 22.06 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.128 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.936 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -123.6 27.65 7.29 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-O 122.5 1.143 . . . . 0.0 107.938 177.423 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.539 ' O ' ' O ' ' A' ' 66' ' ' ASN . 1.9 ttm180 -6.33 128.67 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 112.311 -2.222 . . . . 0.0 112.237 -179.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.979 HG21 ' CD1' ' A' ' 25' ' ' ILE . 1.5 m -134.64 36.04 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.954 179.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.594 ' C ' ' O ' ' A' ' 68' ' ' VAL . 23.4 m -17.34 120.55 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.471 -179.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.914 HG21 ' CD2' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -125.92 -168.01 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-O 121.718 0.771 . . . . 0.0 112.447 -178.457 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.601 ' H ' HG12 ' A' ' 70' ' ' VAL . 0.5 OUTLIER 43.86 -134.49 0.57 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.411 -1.268 . . . . 0.0 111.062 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.439 ' H ' ' HB3' ' A' ' 71' ' ' MET . . . -84.94 23.02 8.25 Favored Glycine 0 N--CA 1.434 -1.45 0 C-N-CA 120.71 -0.757 . . . . 0.0 111.694 179.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 118.03 37.09 0.9 Allowed Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.183 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.586 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 3.3 m-85 -68.64 -177.66 1.0 Allowed 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 1.5 mtmp? -159.53 134.37 7.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.273 0.559 . . . . 0.0 111.972 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.275 HG21 ' CG2' ' A' ' 25' ' ' ILE . 18.8 m -140.07 15.22 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.492 -1.255 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.476 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.868 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 20.42 46.58 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -178.069 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.989 ' OD1' HD11 ' A' ' 26' ' ' LEU . 27.4 t-20 1.18 70.78 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 114.262 -1.335 . . . . 0.0 108.215 -174.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 1.02 ' O ' HD21 ' A' ' 12' ' ' LEU . 33.6 m170 -39.36 111.42 0.18 Allowed 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 122.582 1.182 . . . . 0.0 111.957 -176.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.664 HG23 ' O ' ' A' ' 78' ' ' ASN . 8.9 p -108.16 -9.33 15.58 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.601 -1.636 . . . . 0.0 110.101 -179.375 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.882 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -165.42 128.55 2.19 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 178.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.1 OUTLIER -117.67 143.39 46.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.668 0.271 . . . . 0.0 110.753 -178.935 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.448 ' NE2' ' HA ' ' A' ' 63' ' ' LYS . 0.3 OUTLIER -152.97 116.12 4.62 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.867 0.365 . . . . 0.0 111.516 -179.473 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.07 127.38 31.26 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.512 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.555 ' O ' ' N ' ' A' ' 59' ' ' CYS . 0.4 OUTLIER -149.46 -153.29 0.48 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.764 -179.957 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.5 34.17 0.82 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.947 0.403 . . . . 0.0 110.587 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.479 ' O ' ' O ' ' A' ' 88' ' ' TYR . 0.0 OUTLIER 45.78 -169.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.809 -179.87 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.479 ' O ' ' O ' ' A' ' 87' ' ' CYS . 2.6 p90 -38.27 163.8 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.928 0.394 . . . . 0.0 111.284 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.443 ' HB3' ' CE1' ' A' ' 90' ' ' HIS . 14.1 m-85 -130.72 -92.62 0.42 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.537 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.443 ' CE1' ' HB3' ' A' ' 89' ' ' TYR . 0.0 OUTLIER -131.55 86.74 2.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.548 179.535 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 90' ' ' HIS . 3.2 ttmt 65.41 118.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.778 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.183 -0.913 . . . . 0.0 110.906 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 1.021 ' H82' HD11 ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.576 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . 0.455 ' H61' ' H2 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . 0.455 ' H2 ' ' H61' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . 0.753 ' H3 ' ' O2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . 0.753 ' O2 ' ' H3 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.262 0 CA-C-O 120.838 0.351 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.486 ' O ' ' O ' ' A' ' 3' ' ' ASP . 94.0 Cg_exo -38.11 -39.18 0.9 Allowed 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.912 2.408 . . . . 0.0 112.481 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.486 ' O ' ' O ' ' A' ' 2' ' ' PRO . 0.2 OUTLIER 35.65 -158.88 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.983 179.912 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 47.2 t -110.59 146.66 15.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.114 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.515 ' O ' ' CB ' ' A' ' 6' ' ' ASP . 23.9 mt-30 -106.92 81.73 1.6 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.83 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.515 ' CB ' ' O ' ' A' ' 5' ' ' GLN . 0.0 OUTLIER 162.21 159.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.849 0.357 . . . . 0.0 111.202 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 6' ' ' ASP . 0.5 OUTLIER 174.27 151.07 0.25 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.986 179.608 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.613 ' O ' ' HB2' ' A' ' 31' ' ' CYS . 65.9 Cg_endo -81.38 -123.45 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.888 2.392 . . . . 0.0 110.36 178.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.574 ' O ' ' N ' ' A' ' 11' ' ' THR . 2.1 mp0 -149.22 -175.76 5.1 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.052 0.453 . . . . 0.0 110.704 178.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.655 ' N ' ' O ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -47.29 86.52 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.829 179.867 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.593 ' O ' ' N ' ' A' ' 29' ' ' MET . 0.0 OUTLIER -115.19 156.04 26.06 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.388 -178.944 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.102 HD21 ' O ' ' A' ' 79' ' ' HIS . 3.5 mp -51.2 123.07 8.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.243 179.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.704 ' O ' ' O ' ' A' ' 14' ' ' GLU . 2.0 mm-40 -123.34 61.45 1.05 Allowed 'General case' 0 CA--C 1.502 -0.895 0 CA-C-O 122.251 1.024 . . . . 0.0 110.933 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.704 ' O ' ' O ' ' A' ' 13' ' ' GLN . 16.6 tt0 8.29 126.92 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 112.484 -2.144 . . . . 0.0 112.313 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.866 ' ND2' HG11 ' A' ' 76' ' ' VAL . 1.4 t-20 -49.86 128.96 21.11 Favored Pre-proline 0 C--N 1.311 -1.096 0 CA-C-N 114.232 -1.349 . . . . 0.0 111.253 179.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -86.06 27.87 0.57 Allowed 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.598 2.198 . . . . 0.0 111.517 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.565 ' HB2' ' HE1' ' A' ' 71' ' ' MET . 54.2 t80 -143.29 -52.65 0.36 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.924 -179.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.966 ' CE2' HG23 ' A' ' 68' ' ' VAL . 0.2 OUTLIER -74.86 -15.43 60.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.28 -179.163 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.92 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -55.5 92.54 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.315 -179.547 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.541 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.1 OUTLIER -121.07 166.51 15.66 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-O 120.916 0.388 . . . . 0.0 111.147 179.803 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.5 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 31.2 Cg_exo -59.28 64.46 0.06 OUTLIER 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.992 2.461 . . . . 0.0 112.194 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.541 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 144.94 -9.89 1.81 Allowed Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.35 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.999 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -153.19 99.13 2.71 Favored Pre-proline 0 CA--C 1.51 -0.583 0 CA-C-O 122.02 0.914 . . . . 0.0 111.798 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.92 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 71.7 Cg_endo -107.64 72.71 0.02 OUTLIER 'Trans proline' 0 N--CA 1.436 -1.878 0 C-N-CA 124.965 3.777 . . . . 0.0 113.251 -178.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.237 ' CG2' HG21 ' A' ' 76' ' ' VAL . 22.7 mm -40.09 -176.89 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.043 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.158 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.018 HD11 ' OD1' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -148.58 -159.58 1.05 Allowed 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 122.484 1.135 . . . . 0.0 113.826 -176.356 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.539 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 1.2 tp-100 160.01 75.29 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 112.921 -1.945 . . . . 0.0 110.802 179.646 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 2.3 m -22.74 111.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.618 -179.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.593 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.8 OUTLIER -144.69 130.5 19.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.638 179.64 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 173.13 -115.49 0.56 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.164 -1.017 . . . . 0.0 113.54 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.655 ' O ' ' N ' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -115.35 -164.36 0.94 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.276 0.56 . . . . 0.0 111.706 -179.263 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.645 ' CB ' ' O ' ' A' ' 31' ' ' CYS . 4.1 t 106.34 -139.31 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.98 -1.009 . . . . 0.0 109.811 -179.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.91 ' H ' HG23 ' A' ' 58' ' ' THR . 0.0 OUTLIER 56.07 -166.48 0.12 Allowed 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.585 179.025 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -147.22 -168.37 3.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.961 0.41 . . . . 0.0 111.364 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -77.18 144.55 38.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.133 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -110.23 20.01 18.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.912 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.424 ' O ' ' O ' ' A' ' 38' ' ' PRO . 0.9 OUTLIER -118.65 120.5 31.66 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.915 -179.968 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.48 ' O ' ' HB ' ' A' ' 39' ' ' THR . 96.3 Cg_exo -46.25 179.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.219 0 C-N-CA 122.683 2.256 . . . . 0.0 112.372 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.55 ' OG1' ' HD2' ' A' ' 40' ' ' PRO . 1.3 t 169.57 155.05 0.18 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.784 -179.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.55 ' HD2' ' OG1' ' A' ' 39' ' ' THR . 90.4 Cg_exo -30.68 -38.08 0.05 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 122.814 2.343 . . . . 0.0 112.022 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.493 ' O ' ' O ' ' A' ' 39' ' ' THR . 0.1 OUTLIER -73.16 -173.53 1.33 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.639 179.688 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.454 ' O ' ' HD3' ' A' ' 44' ' ' LYS . 5.1 mtp-105 -158.86 -37.43 0.06 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.52 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.511 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 1.1 m 41.63 -149.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.893 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.511 ' HB2' ' O ' ' A' ' 43' ' ' SER . 0.1 OUTLIER 68.76 33.16 3.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.184 179.893 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.45 ' O ' ' O ' ' A' ' 46' ' ' THR . 9.0 ttpp -115.2 -37.85 3.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.63 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.45 ' O ' ' O ' ' A' ' 45' ' ' LYS . 24.1 p 44.48 -173.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.934 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.2 -74.28 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.122 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.657 ' C ' HG23 ' A' ' 49' ' ' VAL . 0.9 OUTLIER -145.0 71.91 1.31 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.94 -179.747 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.657 HG23 ' C ' ' A' ' 48' ' ' LEU . 1.2 t 69.87 -144.82 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.142 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.533 ' O ' ' N ' ' A' ' 52' ' ' ASN . 0.3 OUTLIER -174.63 105.42 0.1 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.561 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.53 ' O ' ' HB2' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -56.47 77.75 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.153 -179.546 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.533 ' N ' ' O ' ' A' ' 50' ' ' GLN . 10.9 t-20 174.64 104.26 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.907 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.2 m -53.31 175.14 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.827 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 60.9 p 51.01 93.57 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.933 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -161.89 125.31 3.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.918 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -145.27 -35.55 0.31 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.096 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 38.3 m -133.58 -95.36 0.3 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.781 0.324 . . . . 0.0 111.096 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.91 HG23 ' H ' ' A' ' 33' ' ' PHE . 0.2 OUTLIER -59.97 -165.71 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.969 0.414 . . . . 0.0 111.059 -179.892 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.655 ' H ' HG22 ' A' ' 58' ' ' THR . 1.8 t -162.23 28.04 0.11 Allowed 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.788 0.804 . . . . 0.0 110.66 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.649 ' O ' HG12 ' A' ' 61' ' ' VAL . 0.1 OUTLIER -74.57 -162.38 0.16 Allowed 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.538 179.333 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.745 ' O ' HG13 ' A' ' 61' ' ' VAL . 4.3 p 116.08 42.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 114.291 -1.322 . . . . 0.0 109.317 -179.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.763 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 37.29 113.78 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.527 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.74 ' N ' ' O ' ' A' ' 81' ' ' ALA . 4.3 ttmm -52.33 -39.66 60.93 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.674 0.75 . . . . 0.0 109.014 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.529 ' HB3' ' OG1' ' A' ' 80' ' ' THR . 4.4 m -141.13 139.78 34.01 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.971 178.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.684 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 7.2 p90 -123.51 159.38 29.24 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.181 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.928 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -126.71 26.07 6.3 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 122.825 1.298 . . . . 0.0 107.826 176.87 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.522 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -3.0 129.75 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 111.912 -2.404 . . . . 0.0 113.766 -179.273 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.966 HG23 ' CE2' ' A' ' 18' ' ' PHE . 1.9 m -149.26 87.7 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.962 178.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.663 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 98.7 m -57.5 127.0 29.82 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.6 0.714 . . . . 0.0 111.955 -178.04 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.831 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -126.27 -170.23 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 114.684 -1.144 . . . . 0.0 111.124 179.383 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.565 ' HE1' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER 30.55 -136.55 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.058 179.592 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -73.23 21.57 1.06 Allowed Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.695 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.642 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 115.54 33.75 1.54 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.555 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.663 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.2 m-85 -69.0 110.46 4.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.106 0.479 . . . . 0.0 111.233 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.81 89.63 5.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.807 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.237 HG21 ' CG2' ' A' ' 25' ' ' ILE . 25.5 m -78.76 13.89 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.495 -1.155 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.904 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.7 ' O ' ' C ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER 23.76 44.74 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 105.685 -1.969 . . . . 0.0 105.685 -177.698 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 1.018 ' OD1' HD11 ' A' ' 26' ' ' LEU . 26.6 t-20 1.48 71.96 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.096 0 CA-C-N 114.196 -1.365 . . . . 0.0 108.371 -174.22 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 1.102 ' O ' HD21 ' A' ' 12' ' ' LEU . 36.4 m170 -41.85 111.6 0.25 Allowed 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 122.644 1.211 . . . . 0.0 111.93 -176.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.582 HG23 ' O ' ' A' ' 78' ' ' ASN . 7.6 p -104.53 -3.32 24.05 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 113.6 -1.637 . . . . 0.0 109.628 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.74 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -171.96 138.6 1.05 Allowed 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.2 OUTLIER -120.86 157.24 30.23 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.729 -0.389 . . . . 0.0 111.325 -179.031 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.574 ' O ' ' O ' ' A' ' 59' ' ' CYS . 0.4 OUTLIER -165.75 106.22 0.73 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.343 179.553 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.672 ' HB2' HG22 ' A' ' 58' ' ' THR . 3.9 p -118.38 160.2 22.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.441 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.491 ' C ' ' O ' ' A' ' 84' ' ' CYS . 3.7 p 28.68 37.17 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.923 0.392 . . . . 0.0 110.959 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.569 ' N ' ' O ' ' A' ' 84' ' ' CYS . 0.2 OUTLIER -170.39 50.54 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.604 -179.743 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 86.2 m -80.56 51.37 1.46 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.918 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.567 ' O ' ' CB ' ' A' ' 89' ' ' TYR . 0.4 OUTLIER -152.61 -160.19 1.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.79 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.567 ' CB ' ' O ' ' A' ' 88' ' ' TYR . 0.2 OUTLIER 90.69 -72.66 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.909 -179.898 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.465 ' O ' ' O ' ' A' ' 91' ' ' LYS . 1.6 t60 -104.79 137.87 41.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.87 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.465 ' O ' ' O ' ' A' ' 90' ' ' HIS . 0.0 OUTLIER 39.19 97.6 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.991 179.901 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.8 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.891 -179.942 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 0.999 ' H83' ' HB1' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.563 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . 0.417 ' O4 ' ' H3 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . 0.417 ' H3 ' ' O4 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.591 ' H3 ' ' O5 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . 0.591 ' O5 ' ' H3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.755 ' HB3' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.284 0 CA-C-O 120.872 0.368 . . . . 0.0 111.102 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.755 ' HD3' ' HB3' ' A' ' 1' ' ' ALA . 58.6 Cg_endo -72.09 -91.59 0.01 OUTLIER 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.912 2.408 . . . . 0.0 112.486 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.404 ' O ' ' HB ' ' A' ' 4' ' ' VAL . 0.2 OUTLIER 50.14 50.46 18.55 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.757 -179.933 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.404 ' HB ' ' O ' ' A' ' 3' ' ' ASP . 11.5 t 74.99 83.52 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.007 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -142.07 96.83 3.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.673 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.406 ' OD1' ' C ' ' A' ' 6' ' ' ASP . 1.8 p30 -141.35 176.07 9.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.977 -179.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.549 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -68.54 -60.49 4.68 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.14 179.944 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.571 ' O ' ' HB3' ' A' ' 9' ' ' GLU . 14.8 Cg_exo -32.87 104.94 0.03 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 123.18 2.587 . . . . 0.0 112.388 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.571 ' HB3' ' O ' ' A' ' 8' ' ' PRO . 32.5 tt0 83.09 116.96 0.05 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.329 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.587 ' C ' HG22 ' A' ' 11' ' ' THR . 0.1 OUTLIER -82.98 151.72 25.74 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.215 179.419 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.903 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.2 OUTLIER -168.99 -135.14 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.326 179.917 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.119 HD21 ' O ' ' A' ' 79' ' ' HIS . 0.5 OUTLIER -114.38 129.71 56.66 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.668 179.83 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.668 ' HG3' ' CB ' ' A' ' 29' ' ' MET . 1.8 mm-40 -97.84 44.83 1.03 Allowed 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 121.7 0.762 . . . . 0.0 110.81 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.797 ' HG3' HD23 ' A' ' 26' ' ' LEU . 5.9 tt0 -5.22 122.8 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 113.617 -1.629 . . . . 0.0 110.945 -179.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.852 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.6 OUTLIER -69.38 105.07 0.91 Allowed Pre-proline 0 C--N 1.309 -1.156 0 CA-C-N 114.691 -1.14 . . . . 0.0 113.095 -178.343 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.516 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 3.7 Cg_exo -78.33 3.81 6.82 Favored 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 122.819 2.346 . . . . 0.0 109.472 177.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.507 ' HB3' ' OD1' ' A' ' 15' ' ' ASN . 1.3 t80 -94.61 -63.35 1.19 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 113.874 -1.512 . . . . 0.0 110.08 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 1.059 ' CG ' HG21 ' A' ' 70' ' ' VAL . 8.4 m-85 -79.7 -0.39 33.89 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.362 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.769 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -53.94 104.18 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.942 -179.793 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.712 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 0.3 OUTLIER -106.43 177.17 1.41 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.833 179.85 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.525 ' HD2' ' HB2' ' A' ' 20' ' ' GLN . 35.1 Cg_exo -59.55 68.23 0.06 OUTLIER 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.676 2.251 . . . . 0.0 112.018 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.528 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 124.65 19.51 2.51 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.395 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 1.218 ' CB ' ' H83' ' A' ' 178' ' ' NAG . . . -167.0 100.77 0.64 Allowed Pre-proline 0 CA--C 1.509 -0.61 0 CA-C-O 121.952 0.882 . . . . 0.0 110.971 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.793 ' O ' ' O ' ' A' ' 25' ' ' ILE . 28.1 Cg_endo -94.35 23.85 0.42 Allowed 'Trans proline' 0 N--CA 1.452 -0.968 0 C-N-CA 124.525 3.484 . . . . 0.0 113.049 -178.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.143 ' CG2' HG21 ' A' ' 76' ' ' VAL . 9.8 mm 25.38 -174.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 114.684 -1.144 . . . . 0.0 113.046 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.091 HD13 ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -159.75 -160.61 0.83 Allowed 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -174.723 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.595 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 2.6 tp60 161.27 59.5 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 112.176 -2.284 . . . . 0.0 110.477 179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.687 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 73.6 m -15.87 121.29 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.266 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.668 ' CB ' ' HG3' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -156.68 127.96 6.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.757 179.063 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 170.9 -130.81 2.06 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.324 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 70.7 m -144.24 118.98 9.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.77 0.319 . . . . 0.0 110.824 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.607 ' O ' ' CD1' ' A' ' 33' ' ' PHE . 33.8 t -57.11 -66.75 0.4 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.92 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.607 ' CD1' ' O ' ' A' ' 32' ' ' CYS . 0.7 OUTLIER 162.03 -79.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.827 -179.86 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.501 ' C ' ' O ' ' A' ' 33' ' ' PHE . 1.4 t 27.42 90.19 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.071 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.499 ' C ' ' O ' ' A' ' 34' ' ' SER . 7.9 ttm180 -25.76 139.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.481 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.429 ' N ' ' HG2' ' A' ' 35' ' ' ARG . . . -133.36 -139.98 0.19 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.743 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.573 ' N ' ' HD3' ' A' ' 38' ' ' PRO . 1.0 OUTLIER -139.67 49.22 1.87 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 120.828 0.347 . . . . 0.0 111.024 179.907 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.573 ' HD3' ' N ' ' A' ' 37' ' ' TYR . 95.8 Cg_endo -84.0 122.49 2.97 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.849 2.366 . . . . 0.0 112.24 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.788 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 88.5 m -72.84 -34.12 2.36 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.409 0.623 . . . . 0.0 111.378 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.788 ' CD ' ' N ' ' A' ' 39' ' ' THR . 93.5 Cg_endo -88.62 104.18 0.44 Allowed 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 123.92 3.08 . . . . 0.0 112.837 -179.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.493 HD21 ' HG2' ' A' ' 38' ' ' PRO . 81.7 mt -132.98 -51.16 0.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.19 0.519 . . . . 0.0 109.93 179.378 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -128.56 11.11 6.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.001 179.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -168.69 135.4 1.88 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.345 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -83.21 52.35 2.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.209 -179.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.39 148.91 30.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.52 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.76 107.51 7.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.712 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.474 ' O ' ' O ' ' A' ' 48' ' ' LEU . 0.8 OUTLIER -162.5 62.52 0.21 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.218 -179.746 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.474 ' O ' ' O ' ' A' ' 47' ' ' MET . 0.1 OUTLIER 35.6 96.54 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.015 179.887 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.532 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -146.96 94.13 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.898 179.885 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.532 ' CB ' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER 156.62 92.5 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.196 -179.603 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.608 ' O ' ' CB ' ' A' ' 52' ' ' ASN . 7.5 ttpp -131.8 10.87 4.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.583 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.608 ' CB ' ' O ' ' A' ' 51' ' ' LYS . 2.9 m-20 150.15 147.47 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.459 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.54 ' CG1' ' O ' ' A' ' 52' ' ' ASN . 22.0 m -163.64 -164.25 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.664 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.615 ' O ' ' CB ' ' A' ' 55' ' ' SER . 0.0 OUTLIER -43.44 -86.55 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.651 179.686 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.615 ' CB ' ' O ' ' A' ' 54' ' ' THR . 2.1 m 146.66 54.51 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.797 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.497 ' CB ' ' O ' ' A' ' 55' ' ' SER . 2.0 tm-20 83.15 97.19 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.83 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.75 -170.77 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.893 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 16.9 p -73.44 168.35 19.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.073 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.519 ' C ' ' HA ' ' A' ' 84' ' ' CYS . 30.0 p -145.04 129.34 17.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.014 0.435 . . . . 0.0 110.944 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.673 ' HB2' ' HB3' ' A' ' 82' ' ' CYS . 22.2 p -51.94 130.84 30.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.8 -179.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.849 HG12 ' O ' ' A' ' 61' ' ' VAL . 25.3 t -128.06 64.01 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.354 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.819 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 26.18 92.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.431 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.86 ' N ' ' O ' ' A' ' 81' ' ' ALA . 8.6 tptp -47.04 -33.84 5.19 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 177.496 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.746 ' O ' ' HB1' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -139.34 -175.61 4.24 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 113.833 -1.531 . . . . 0.0 108.646 178.982 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.907 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -158.88 162.98 37.0 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.554 0.692 . . . . 0.0 112.246 -179.466 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.789 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.2 OUTLIER -133.84 27.53 3.94 Favored 'General case' 0 CA--C 1.504 -0.817 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 176.777 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.631 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -8.66 129.9 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 112.205 -2.27 . . . . 0.0 111.935 -179.607 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 1.029 HG21 ' CD1' ' A' ' 25' ' ' ILE . 4.3 m -134.04 46.85 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.759 179.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.565 ' C ' ' O ' ' A' ' 68' ' ' VAL . 41.1 m -20.09 118.56 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.993 -178.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 1.059 HG21 ' CG ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -123.41 -170.0 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.109 -179.048 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.639 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 80.7 mtp 38.99 -134.23 0.14 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.635 179.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -75.87 12.33 8.99 Favored Glycine 0 N--CA 1.441 -0.992 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.976 -179.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 122.1 37.67 0.64 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.236 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.639 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 7.1 m-85 -67.14 -176.27 0.53 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.94 92.85 0.87 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.722 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.143 HG21 ' CG2' ' A' ' 25' ' ' ILE . 29.8 m -86.24 10.6 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.342 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.907 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.5 OUTLIER 30.53 39.38 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 -176.986 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.974 ' HB2' HG13 ' A' ' 68' ' ' VAL . 48.7 t30 1.75 64.69 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 113.081 -1.872 . . . . 0.0 108.26 -174.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 1.119 ' O ' HD21 ' A' ' 12' ' ' LEU . 32.8 m170 -31.73 121.49 0.27 Allowed 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 112.764 -2.017 . . . . 0.0 113.28 -176.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.565 ' OG1' ' HB2' ' A' ' 64' ' ' SER . 6.9 p -111.08 -13.64 14.02 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 113.999 -1.455 . . . . 0.0 110.568 -179.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.86 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -164.18 135.26 4.42 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.458 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.944 ' SG ' HD12 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -114.03 127.1 55.79 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.474 -0.49 . . . . 0.0 112.23 -178.765 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.494 ' CG ' ' O ' ' A' ' 83' ' ' HIS . 1.7 p80 -122.49 116.56 24.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.934 178.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.554 ' HA ' ' HA ' ' A' ' 60' ' ' CYS . 31.6 p -69.62 146.73 51.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.082 0.468 . . . . 0.0 111.478 -179.131 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.444 ' OG ' ' N ' ' A' ' 86' ' ' THR . 0.1 OUTLIER -179.78 177.04 0.72 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.853 -179.866 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.444 ' N ' ' OG ' ' A' ' 85' ' ' SER . 4.2 t -34.63 135.66 0.17 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.141 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 3.9 m -115.11 -170.69 1.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.602 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.489 ' O ' ' O ' ' A' ' 89' ' ' TYR . 0.1 OUTLIER 40.4 48.22 2.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.595 179.892 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.543 ' CD1' ' N ' ' A' ' 89' ' ' TYR . 0.0 OUTLIER -36.91 163.28 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.118 -179.71 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -129.99 64.97 1.51 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.888 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 71.08 -71.12 0.14 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.981 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.843 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 1.218 ' H83' ' CB ' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.602 ' H3 ' ' O7 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . 0.485 ' H61' ' H2 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . 0.485 ' H2 ' ' H61' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . 0.622 ' H4 ' ' O2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . 0.622 ' O2 ' ' H4 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.854 0.359 . . . . 0.0 111.077 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.538 ' O ' ' CB ' ' A' ' 3' ' ' ASP . 19.0 Cg_endo -57.91 -168.43 0.03 OUTLIER 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.703 2.268 . . . . 0.0 111.851 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.538 ' CB ' ' O ' ' A' ' 2' ' ' PRO . 0.3 OUTLIER 85.47 -17.44 0.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.179 179.931 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.434 ' H ' HG23 ' A' ' 4' ' ' VAL . 1.4 t -70.81 -138.79 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.945 179.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.411 HE21 ' HB3' ' A' ' 5' ' ' GLN . 0.9 OUTLIER -139.41 23.28 2.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.839 0.352 . . . . 0.0 111.228 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.7 t70 179.99 155.02 0.58 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.677 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -179.57 83.18 0.2 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.822 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -85.11 59.34 5.34 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 123.116 2.544 . . . . 0.0 113.046 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.481 ' HA ' ' O ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER 72.75 172.62 0.3 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.963 0.411 . . . . 0.0 111.424 179.386 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.71 ' O ' HG23 ' A' ' 11' ' ' THR . 0.1 OUTLIER -95.46 145.64 25.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.843 179.849 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.71 HG23 ' O ' ' A' ' 10' ' ' CYS . 0.3 OUTLIER 157.66 164.92 0.01 OUTLIER 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.339 0.59 . . . . 0.0 111.973 178.946 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.242 HD21 ' O ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER -67.59 113.33 5.32 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.997 -1.002 . . . . 0.0 109.602 178.205 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.605 ' HG3' ' HB2' ' A' ' 29' ' ' MET . 1.3 mm-40 -101.77 52.75 0.82 Allowed 'General case' 0 CA--C 1.499 -0.997 0 CA-C-O 122.119 0.962 . . . . 0.0 110.527 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.595 ' C ' ' O ' ' A' ' 13' ' ' GLN . 4.7 tt0 -4.47 118.0 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 112.761 -2.018 . . . . 0.0 110.845 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.697 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.4 OUTLIER -54.63 102.54 0.31 Allowed Pre-proline 0 C--N 1.302 -1.489 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.382 -178.787 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.454 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 1.4 Cg_endo -76.65 1.33 8.62 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.223 1.949 . . . . 0.0 109.046 177.349 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.736 ' CE1' ' HE1' ' A' ' 71' ' ' MET . 1.1 t80 -93.51 -53.64 3.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 113.518 -1.674 . . . . 0.0 110.08 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.88 ' CE2' HG21 ' A' ' 70' ' ' VAL . 4.0 m-85 -87.5 -4.98 58.99 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.63 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.646 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.7 OUTLIER -48.46 97.36 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.346 179.402 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.62 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -101.23 158.28 32.09 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.667 -179.511 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.438 ' CD ' ' HG3' ' A' ' 20' ' ' GLN . 32.5 Cg_exo -57.98 65.76 0.05 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.582 2.188 . . . . 0.0 111.044 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.62 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 134.66 1.06 3.49 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.168 -179.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 1.069 ' CB ' ' H83' ' A' ' 178' ' ' NAG . . . -150.82 99.99 3.1 Favored Pre-proline 0 CA--C 1.512 -0.519 0 CA-C-O 122.022 0.915 . . . . 0.0 111.424 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.646 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 93.2 Cg_endo -103.23 78.87 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.414 0 C-N-CA 124.809 3.673 . . . . 0.0 113.318 -178.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.182 ' CG2' HG21 ' A' ' 76' ' ' VAL . 15.3 mm -40.45 -177.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.014 HD13 HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -150.75 -162.76 1.62 Allowed 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 122.413 1.102 . . . . 0.0 113.662 -175.856 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.546 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 7.5 tp-100 166.92 59.76 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 112.918 -1.947 . . . . 0.0 111.104 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.644 ' HA ' ' O ' ' A' ' 11' ' ' THR . 7.4 t -28.2 99.71 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.975 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.605 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 8.2 tpt -61.44 164.11 6.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.206 178.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.685 ' HA2' ' HB2' ' A' ' 10' ' ' CYS . . . -132.81 101.36 0.44 Allowed Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.184 -1.008 . . . . 0.0 113.131 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.481 ' O ' ' HA ' ' A' ' 9' ' ' GLU . 1.8 m -158.53 52.59 0.42 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.847 0.356 . . . . 0.0 110.73 179.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.662 ' O ' ' CB ' ' A' ' 33' ' ' PHE . 0.7 OUTLIER -41.66 -74.9 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.714 -179.967 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.662 ' CB ' ' O ' ' A' ' 32' ' ' CYS . 16.5 m-85 114.33 5.63 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.043 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.481 ' O ' ' O ' ' A' ' 33' ' ' PHE . 0.3 OUTLIER 57.32 127.4 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.804 179.864 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.417 ' O ' ' HG3' ' A' ' 35' ' ' ARG . 11.8 ptt-85 -128.67 16.58 6.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.824 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -145.48 138.46 26.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.453 -179.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.533 ' CB ' ' HD3' ' A' ' 38' ' ' PRO . 0.2 OUTLIER 179.92 -54.34 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.263 179.679 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.533 ' HD3' ' CB ' ' A' ' 37' ' ' TYR . 1.0 OUTLIER -83.11 156.63 15.02 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 123.372 2.715 . . . . 0.0 112.082 179.696 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.673 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -133.91 37.02 0.35 Allowed Pre-proline 0 C--N 1.327 -0.386 0 CA-C-O 120.987 0.422 . . . . 0.0 110.978 179.817 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.673 ' CD ' ' N ' ' A' ' 39' ' ' THR . 60.5 Cg_endo -72.49 50.77 1.7 Allowed 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.643 2.229 . . . . 0.0 112.171 179.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.507 ' N ' HD12 ' A' ' 41' ' ' LEU . 0.2 OUTLIER -164.01 50.54 0.13 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.007 -179.628 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 65.6 -124.52 0.35 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.653 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 61.41 -152.07 0.38 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.737 0.303 . . . . 0.0 110.887 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.468 ' HG2' ' N ' ' A' ' 45' ' ' LYS . 32.7 ttmt -164.99 154.32 12.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.759 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.468 ' N ' ' HG2' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -163.72 153.66 15.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.008 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.619 HG23 ' N ' ' A' ' 47' ' ' MET . 7.3 t -161.63 -145.48 0.11 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.595 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.619 ' N ' HG23 ' A' ' 46' ' ' THR . 3.9 mtt -89.68 27.7 1.46 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.946 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.402 ' C ' ' O ' ' A' ' 47' ' ' MET . 0.8 OUTLIER 38.05 68.29 0.33 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.711 -179.927 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -102.06 168.37 2.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.229 -179.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.539 ' O ' ' CB ' ' A' ' 51' ' ' LYS . 5.3 mm-40 49.06 20.01 0.34 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.204 179.685 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.539 ' CB ' ' O ' ' A' ' 50' ' ' GLN . 0.7 OUTLIER 156.74 117.13 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.789 0.328 . . . . 0.0 111.092 179.991 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 20.9 t30 -141.47 111.65 6.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.531 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -134.43 13.78 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.63 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.429 HG23 ' O ' ' A' ' 54' ' ' THR . 13.9 t -168.66 121.14 0.81 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.149 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 5.7 m -144.0 -168.94 2.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.7 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.5 ' O ' ' CB ' ' A' ' 57' ' ' SER . 2.4 pt-20 -71.51 117.8 13.53 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.081 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 56' ' ' GLU . 0.4 OUTLIER 160.56 154.03 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.52 179.98 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.627 ' O ' ' CB ' ' A' ' 59' ' ' CYS . 65.0 p -150.26 179.35 8.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.275 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.627 ' CB ' ' O ' ' A' ' 58' ' ' THR . 4.5 m 138.62 122.06 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.353 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.552 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 62.7 m -105.81 67.86 0.77 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.419 -179.444 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.606 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -80.94 70.79 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.349 179.394 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.834 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 21.12 111.56 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.435 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.639 ' N ' ' O ' ' A' ' 81' ' ' ALA . 2.5 ttmt -52.04 -36.76 51.33 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 178.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.615 ' O ' ' HB1' ' A' ' 62' ' ' ALA . 3.5 m -136.09 178.02 7.38 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.273 -1.331 . . . . 0.0 108.863 179.116 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.707 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 2.7 p90 -158.27 157.09 31.85 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.085 -0.646 . . . . 0.0 112.572 -179.639 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.92 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 0.4 OUTLIER -127.42 24.99 6.17 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-O 122.705 1.24 . . . . 0.0 107.989 176.501 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.684 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 3.3 ptt85 -2.87 120.05 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 112.144 -2.298 . . . . 0.0 112.198 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 1.017 HG21 ' CD1' ' A' ' 25' ' ' ILE . 2.5 m -124.42 45.23 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.504 179.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.61 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 94.5 m -20.12 119.55 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 121.17 0.509 . . . . 0.0 110.747 -178.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.88 HG21 ' CE2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -122.88 -164.02 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.005 -179.169 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.736 ' HE1' ' CE1' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -28.3 138.72 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.45 -1.25 . . . . 0.0 111.323 -179.583 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 57.04 11.94 6.68 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.005 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 70' ' ' VAL . . . 74.96 39.29 38.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.141 -179.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.61 ' O ' ' HA ' ' A' ' 69' ' ' THR . 12.9 m-85 -73.48 114.51 11.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.95 0.405 . . . . 0.0 111.219 -179.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.7 mtmm -95.57 95.81 8.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.734 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.182 HG21 ' CG2' ' A' ' 25' ' ' ILE . 26.8 m -83.59 10.7 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.35 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.707 ' O ' ' CB ' ' A' ' 65' ' ' TYR . 0.3 OUTLIER 28.15 40.44 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 -177.145 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.92 ' HB3' ' CA ' ' A' ' 66' ' ' ASN . 9.9 t-20 8.96 63.17 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.991 0 CA-C-N 113.932 -1.485 . . . . 0.0 107.42 -175.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 1.242 ' O ' HD21 ' A' ' 12' ' ' LEU . 28.5 m170 -37.76 99.8 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.233 0 CA-C-O 122.498 1.142 . . . . 0.0 111.781 -175.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.721 HG23 ' O ' ' A' ' 78' ' ' ASN . 10.2 p -95.9 0.25 51.76 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 113.781 -1.554 . . . . 0.0 111.347 -178.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.639 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -167.8 146.81 4.78 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.038 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.862 ' SG ' HD12 ' A' ' 12' ' ' LEU . 84.2 m -120.4 170.19 9.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.827 0.346 . . . . 0.0 111.428 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.552 ' O ' ' HA ' ' A' ' 60' ' ' CYS . 0.3 OUTLIER -175.27 108.91 0.1 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.936 179.717 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.519 ' O ' ' CB ' ' A' ' 85' ' ' SER . 3.2 t -82.48 114.0 20.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.914 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.519 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 0.1 OUTLIER 160.69 179.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.001 0.429 . . . . 0.0 111.391 179.64 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.491 ' O ' ' HB3' ' A' ' 87' ' ' CYS . 0.2 OUTLIER 39.66 -146.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.303 179.886 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.491 ' HB3' ' O ' ' A' ' 86' ' ' THR . 0.0 OUTLIER 77.42 136.13 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.608 -179.728 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 49.42 -141.62 0.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.488 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -155.1 -77.96 0.1 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.681 0.277 . . . . 0.0 111.297 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.504 ' CE1' ' OG ' ' A' ' 92' ' ' SER . 1.9 t60 59.38 100.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.954 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.413 ' C ' ' OG ' ' A' ' 92' ' ' SER . 0.0 OUTLIER -101.77 141.24 34.92 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.111 -179.829 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.504 ' OG ' ' CE1' ' A' ' 90' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.145 -0.931 . . . . 0.0 110.991 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 1.069 ' H83' ' CB ' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.748 ' O7 ' ' C3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . 0.729 ' H5 ' ' O5 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . 0.729 ' O5 ' ' H5 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.873 ' HB3' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.488 1.433 0 CA-C-O 120.625 0.25 . . . . 0.0 111.204 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.873 ' CD ' ' HB3' ' A' ' 1' ' ' ALA . 10.2 Cg_endo -50.11 -34.93 40.51 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.77 2.314 . . . . 0.0 111.808 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -80.96 -41.02 23.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.728 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.514 ' O ' ' CB ' ' A' ' 5' ' ' GLN . 5.5 p -145.79 140.56 21.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.969 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.514 ' CB ' ' O ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER 83.37 57.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.691 -179.891 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.489 ' OD1' ' N ' ' A' ' 6' ' ' ASP . 11.6 p-10 -165.14 25.68 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.196 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.515 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 20.5 p -171.0 78.89 0.54 Allowed Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.797 179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -64.44 67.98 0.24 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.626 2.217 . . . . 0.0 112.469 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.52 ' OE1' ' CE1' ' A' ' 33' ' ' PHE . 0.6 OUTLIER 57.16 -177.61 0.06 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.279 179.782 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.4 ' HB3' ' HB2' ' A' ' 82' ' ' CYS . 88.8 m -71.72 131.82 43.67 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.499 -179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.848 ' O ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -161.59 -131.46 0.02 OUTLIER 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.061 179.625 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.266 HD21 ' O ' ' A' ' 79' ' ' HIS . 8.5 mp -145.74 127.04 14.86 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.865 0.364 . . . . 0.0 111.348 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.585 ' O ' ' C ' ' A' ' 14' ' ' GLU . 2.9 mm-40 -92.81 46.6 1.24 Allowed 'General case' 0 CA--C 1.504 -0.813 0 CA-C-O 121.799 0.809 . . . . 0.0 110.397 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.6 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 4.1 tt0 -0.59 117.63 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 113.522 -1.672 . . . . 0.0 111.419 -178.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.984 ' ND2' HG11 ' A' ' 76' ' ' VAL . 1.2 t-20 -58.76 103.93 0.39 Allowed Pre-proline 0 C--N 1.306 -1.288 0 CA-C-N 113.957 -1.474 . . . . 0.0 111.214 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.43 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 3.0 Cg_exo -74.27 14.85 0.68 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.914 2.409 . . . . 0.0 112.167 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.427 ' CE2' ' HG2' ' A' ' 71' ' ' MET . 58.9 t80 -113.42 -50.84 2.84 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.415 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 1.081 ' CD1' HG12 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -79.82 -11.17 59.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.237 -179.549 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.598 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -52.36 104.36 0.09 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.63 -179.391 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.596 ' CG ' ' O ' ' A' ' 18' ' ' PHE . 0.9 OUTLIER -123.14 166.13 19.4 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.581 179.402 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.05 76.99 0.02 OUTLIER 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.703 2.269 . . . . 0.0 112.501 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 119.81 10.23 7.8 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.516 -0.849 . . . . 0.0 112.982 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 1.013 ' CB ' ' H83' ' A' ' 178' ' ' NAG . . . -161.38 98.1 1.28 Allowed Pre-proline 0 CA--C 1.512 -0.504 0 CA-C-O 122.141 0.972 . . . . 0.0 112.227 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.605 ' O ' ' O ' ' A' ' 25' ' ' ILE . 74.2 Cg_endo -106.55 82.45 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.549 1 C-N-CA 125.301 4.001 . . . . 0.0 111.958 -179.356 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.304 ' CG2' HG21 ' A' ' 76' ' ' VAL . 32.8 mm -42.01 -176.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.005 HD13 ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -155.92 -156.97 0.68 Allowed 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 115.028 1.492 . . . . 0.0 115.028 -173.579 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.53 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 1.3 tp-100 160.78 72.19 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 112.637 -2.074 . . . . 0.0 110.575 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.836 ' SG ' ' HB3' ' A' ' 79' ' ' HIS . 73.8 m -21.39 114.15 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.86 -179.078 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.535 ' CE ' ' OE1' ' A' ' 13' ' ' GLN . 7.1 tpp -51.16 -39.69 56.94 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.493 ' O ' ' HB2' ' A' ' 31' ' ' CYS . . . 63.72 119.12 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.997 -0.621 . . . . 0.0 112.876 179.433 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.493 ' HB2' ' O ' ' A' ' 30' ' ' GLY . 24.6 t 176.44 72.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.86 0.362 . . . . 0.0 110.91 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.413 ' HA ' ' OE1' ' A' ' 9' ' ' GLU . 2.8 m -75.98 157.79 32.68 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.16 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.52 ' CE1' ' OE1' ' A' ' 9' ' ' GLU . 34.6 p90 179.15 133.19 0.09 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.14 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 26.7 m 55.78 -173.1 0.06 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.912 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.3 ttt180 -128.41 161.17 30.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.763 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.47 ' O ' ' CD1' ' A' ' 37' ' ' TYR . . . -139.93 63.01 1.5 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.16 0.505 . . . . 0.0 111.047 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.479 ' N ' ' CD ' ' A' ' 38' ' ' PRO . 0.3 OUTLIER -153.01 50.14 0.57 Allowed Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.811 -179.875 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.479 ' CD ' ' N ' ' A' ' 37' ' ' TYR . 7.2 Cg_exo -35.97 130.37 0.35 Allowed 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.359 2.706 . . . . 0.0 112.511 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.472 ' O ' ' O ' ' A' ' 38' ' ' PRO . 11.5 p 54.81 154.61 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.132 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 39' ' ' THR . 29.1 Cg_exo -61.66 160.69 27.48 Favored 'Trans proline' 0 C--O 1.231 0.132 0 C-N-CA 122.94 2.427 . . . . 0.0 112.493 -179.75 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.445 ' O ' ' CB ' ' A' ' 42' ' ' ARG . 37.9 mt -122.61 -137.29 0.31 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.747 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.461 ' O ' ' CB ' ' A' ' 43' ' ' SER . 0.2 OUTLIER 165.59 79.01 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.889 0.376 . . . . 0.0 111.034 179.929 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.461 ' CB ' ' O ' ' A' ' 42' ' ' ARG . 9.2 p 163.94 94.98 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.818 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 52.2 102.27 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.847 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.47 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 0.2 OUTLIER -69.25 -166.12 0.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.704 179.815 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.411 ' O ' ' C ' ' A' ' 47' ' ' MET . 11.0 p -96.34 147.35 23.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.862 0.363 . . . . 0.0 111.07 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.411 ' C ' ' O ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -36.56 142.55 0.09 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.14 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 65.8 mt -125.56 166.92 15.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.312 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.495 HG12 ' H ' ' A' ' 51' ' ' LYS . 0.9 OUTLIER -51.57 162.55 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.867 -179.915 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.5 ' O ' ' HG2' ' A' ' 50' ' ' GLN . 4.4 pm0 -101.31 48.85 0.88 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.734 -179.211 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.601 ' O ' ' ND2' ' A' ' 52' ' ' ASN . 0.0 OUTLIER 73.55 84.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.677 179.107 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.601 ' ND2' ' O ' ' A' ' 51' ' ' LYS . 0.7 OUTLIER 150.89 133.08 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.84 0.353 . . . . 0.0 111.38 179.153 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' ' 53' ' ' VAL . 17.0 m -135.25 88.38 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.867 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.498 ' O ' ' HB3' ' A' ' 55' ' ' SER . 15.4 p -140.92 158.16 44.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.905 0.383 . . . . 0.0 111.063 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.498 ' HB3' ' O ' ' A' ' 54' ' ' THR . 21.3 t 75.12 166.74 0.28 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.245 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.486 ' O ' ' O ' ' A' ' 57' ' ' SER . 0.0 OUTLIER -123.96 -161.21 0.97 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.621 179.768 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.486 ' O ' ' O ' ' A' ' 56' ' ' GLU . 25.6 t 54.97 116.72 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.462 -179.712 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.463 ' C ' ' SG ' ' A' ' 59' ' ' CYS . 0.7 OUTLIER -85.64 139.47 31.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.08 0.467 . . . . 0.0 111.825 -179.145 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.493 ' O ' ' O ' ' A' ' 85' ' ' SER . 0.8 OUTLIER -161.79 128.76 3.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.087 179.25 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.501 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 1.2 m -70.36 123.25 21.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.859 0.362 . . . . 0.0 111.639 -179.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.828 HG12 ' O ' ' A' ' 61' ' ' VAL . 40.5 t -123.41 63.64 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.675 179.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.648 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 32.33 105.59 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.515 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.777 ' N ' ' O ' ' A' ' 81' ' ' ALA . 23.1 tptt -54.49 -42.14 70.4 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.704 0.764 . . . . 0.0 108.946 177.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.579 ' O ' ' N ' ' A' ' 80' ' ' THR . 50.0 m -141.94 123.28 14.82 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.577 179.212 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.735 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 0.4 OUTLIER -114.14 158.86 20.73 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.639 0.733 . . . . 0.0 112.93 -177.81 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.944 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -128.55 30.35 5.16 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 176.466 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.687 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -7.6 133.49 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 112.17 -2.286 . . . . 0.0 112.401 -179.35 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 1.043 HG21 HG13 ' A' ' 25' ' ' ILE . 2.4 m -139.47 45.17 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.87 -179.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.667 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 21.8 m -10.75 119.18 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.649 -179.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 1.081 HG12 ' CD1' ' A' ' 18' ' ' PHE . 4.6 m -120.61 -169.81 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.787 0.804 . . . . 0.0 112.635 -178.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.614 ' HB2' ' CD1' ' A' ' 74' ' ' PHE . 11.1 mtt 37.12 -125.44 0.19 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.304 -1.317 . . . . 0.0 111.087 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -87.74 36.51 3.35 Favored Glycine 0 N--CA 1.437 -1.29 0 CA-C-N 115.399 -0.819 . . . . 0.0 112.682 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.565 ' C ' HG23 ' A' ' 69' ' ' THR . . . 104.33 21.27 9.5 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.118 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.676 ' CB ' HG22 ' A' ' 70' ' ' VAL . 3.8 m-85 -52.15 -177.84 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.607 0.241 . . . . 0.0 111.01 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.563 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -154.34 106.39 2.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 179.753 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.304 HG21 ' CG2' ' A' ' 25' ' ' ILE . 22.8 m -104.95 12.49 8.14 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.368 0 CA-C-O 121.043 0.449 . . . . 0.0 110.477 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.735 ' O ' ' CB ' ' A' ' 65' ' ' TYR . 0.4 OUTLIER 23.7 43.88 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 -178.282 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.944 ' HB3' ' CB ' ' A' ' 66' ' ' ASN . 15.6 t-20 8.2 64.74 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.967 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 -175.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 1.266 ' O ' HD21 ' A' ' 12' ' ' LEU . 26.5 m170 -41.36 90.61 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 122.362 1.077 . . . . 0.0 112.437 -175.412 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.667 HG23 ' O ' ' A' ' 78' ' ' ASN . 4.2 p -83.29 -4.32 58.32 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 113.946 -1.479 . . . . 0.0 110.146 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.777 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -176.23 141.04 0.42 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.616 ' SG ' ' O ' ' A' ' 11' ' ' THR . 1.5 m -114.87 151.68 33.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.825 0.345 . . . . 0.0 110.95 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.615 ' O ' ' CD2' ' A' ' 83' ' ' HIS . 0.3 OUTLIER -152.48 119.44 5.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.936 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.51 ' O ' ' O ' ' A' ' 83' ' ' HIS . 36.1 m -46.13 -177.7 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.181 -179.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.522 ' O ' ' CB ' ' A' ' 86' ' ' THR . 5.2 p 55.48 162.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.703 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.534 ' O ' ' CG2' ' A' ' 61' ' ' VAL . 4.6 m 84.24 100.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.346 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.464 ' HB3' ' HB2' ' A' ' 59' ' ' CYS . 9.8 p 178.05 42.62 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.874 -179.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.509 ' O ' ' CD2' ' A' ' 89' ' ' TYR . 0.1 OUTLIER -170.38 -159.73 0.2 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.828 -179.996 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.509 ' CD2' ' O ' ' A' ' 88' ' ' TYR . 0.5 OUTLIER 167.59 34.27 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.496 179.677 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -110.23 177.09 4.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.634 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.439 ' O ' ' OXT' ' A' ' 92' ' ' SER . 5.4 tttp -168.61 -131.02 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.575 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.439 ' OXT' ' O ' ' A' ' 91' ' ' LYS . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.76 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 1.013 ' H83' ' CB ' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.764 ' O7 ' ' C3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . 0.752 ' C3 ' ' O7 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.566 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . 0.566 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.559 ' HB3' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.843 0.354 . . . . 0.0 111.038 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.559 ' HD3' ' HB3' ' A' ' 1' ' ' ALA . 72.7 Cg_endo -84.15 -62.1 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.849 2.366 . . . . 0.0 112.619 -179.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.483 ' OD1' ' HG2' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -119.7 -173.75 2.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.863 0.363 . . . . 0.0 111.104 -179.803 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.623 ' O ' ' CB ' ' A' ' 5' ' ' GLN . 3.0 p 165.42 99.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.626 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.623 ' CB ' ' O ' ' A' ' 4' ' ' VAL . 25.8 tt0 98.46 75.52 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.741 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -150.27 157.97 43.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.659 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.434 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 3.5 p 176.77 138.17 0.21 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.144 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 7' ' ' CYS . 6.2 Cg_exo -76.75 76.23 4.15 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 123.038 2.492 . . . . 0.0 111.888 179.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.518 ' HA ' ' O ' ' A' ' 31' ' ' CYS . 4.8 tt0 60.78 150.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.613 -179.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.581 ' CB ' ' HA2' ' A' ' 30' ' ' GLY . 28.1 p -30.98 123.94 0.21 Allowed 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.407 179.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.672 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 0.2 OUTLIER -154.47 164.41 38.7 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.457 0.646 . . . . 0.0 111.886 -179.895 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.182 HD21 ' O ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER -67.82 120.31 13.93 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.139 178.553 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.647 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.1 mt-30 -111.0 56.48 0.63 Allowed 'General case' 0 CA--C 1.501 -0.929 0 CA-C-O 122.015 0.912 . . . . 0.0 110.814 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.647 ' O ' ' O ' ' A' ' 13' ' ' GLN . 23.8 tt0 2.91 121.49 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 112.703 -2.044 . . . . 0.0 111.194 -179.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.669 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.4 OUTLIER -48.91 99.23 0.21 Allowed Pre-proline 0 C--N 1.306 -1.318 0 CA-C-N 114.455 -1.248 . . . . 0.0 111.697 -179.289 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.596 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 40.4 Cg_endo -66.51 5.0 0.81 Allowed 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 121.88 1.72 . . . . 0.0 109.765 178.031 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.612 ' CZ ' ' SD ' ' A' ' 71' ' ' MET . 0.6 OUTLIER -103.65 -56.93 2.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 113.883 -1.508 . . . . 0.0 110.514 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.679 ' HB2' ' HB ' ' A' ' 25' ' ' ILE . 0.6 OUTLIER -87.63 -2.33 58.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.007 -179.666 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.774 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.3 m -60.0 86.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.645 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.756 ' CG ' ' HB3' ' A' ' 23' ' ' ALA . 3.4 pt20 -108.67 154.37 41.72 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.788 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -57.14 66.74 0.04 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.23 0 C-N-CA 122.563 2.175 . . . . 0.0 111.232 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.631 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 149.56 -15.36 1.09 Allowed Glycine 0 N--CA 1.449 -0.438 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.681 -179.031 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.764 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -148.21 99.39 3.68 Favored Pre-proline 0 CA--C 1.51 -0.576 0 CA-C-O 122.007 0.908 . . . . 0.0 110.822 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.774 ' HA ' ' HA ' ' A' ' 19' ' ' SER . 62.5 Cg_endo -104.57 66.36 0.02 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.692 0 C-N-CA 124.718 3.612 . . . . 0.0 113.755 -178.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.149 ' CG2' HG21 ' A' ' 76' ' ' VAL . 15.4 mm -39.75 -179.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 N-CA-C 112.789 0.662 . . . . 0.0 112.789 179.174 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.001 ' HB3' HD23 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -148.52 -163.01 1.68 Allowed 'General case' 0 CA--C 1.497 -1.078 0 CA-C-O 122.624 1.202 . . . . 0.0 113.992 -176.073 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.586 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 8.6 tp60 167.77 62.66 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 112.501 -2.136 . . . . 0.0 111.005 179.439 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.672 ' HA ' ' O ' ' A' ' 11' ' ' THR . 1.2 t -28.74 99.72 0.02 OUTLIER 'General case' 0 C--O 1.23 0.075 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.065 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.575 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 19.0 tpp -58.24 -117.49 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.037 -179.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.581 ' HA2' ' CB ' ' A' ' 10' ' ' CYS . . . 172.54 121.45 0.6 Allowed Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.35 -0.929 . . . . 0.0 112.796 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.518 ' O ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -152.74 49.31 0.74 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.168 0.509 . . . . 0.0 110.467 179.593 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.74 112.07 7.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.73 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -102.36 -139.45 0.35 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.003 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 95.3 p -71.4 -176.9 1.63 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.973 0.416 . . . . 0.0 111.488 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.464 ' CB ' ' CZ ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -127.2 -162.78 1.19 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.887 -179.923 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 64.65 107.97 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.878 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.425 ' HA ' ' HD2' ' A' ' 38' ' ' PRO . 3.4 m-30 -83.94 120.48 74.98 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.998 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.425 ' HD2' ' HA ' ' A' ' 37' ' ' TYR . 11.7 Cg_endo -55.79 111.84 0.88 Allowed 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.649 2.233 . . . . 0.0 111.923 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.587 ' CG2' ' HD2' ' A' ' 40' ' ' PRO . 23.3 m -116.16 143.91 31.9 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.796 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.729 ' O ' HD12 ' A' ' 41' ' ' LEU . 49.1 Cg_exo -34.66 140.31 0.09 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.692 2.262 . . . . 0.0 112.429 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.729 HD12 ' O ' ' A' ' 40' ' ' PRO . 1.5 mp 82.63 -54.46 0.2 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.788 -179.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.551 ' O ' ' O ' ' A' ' 41' ' ' LEU . 15.7 ptt180 52.23 125.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.166 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -134.54 132.35 39.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.951 -179.743 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.58 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -85.67 80.12 9.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.908 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 3.0 ttmp? -84.67 69.78 10.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.0 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.62 ' O ' ' CB ' ' A' ' 47' ' ' MET . 15.4 t -89.78 -161.29 0.77 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.921 0.391 . . . . 0.0 111.065 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.626 ' O ' ' CB ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER 145.0 -36.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.876 -179.731 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.626 ' CB ' ' O ' ' A' ' 47' ' ' MET . 0.1 OUTLIER 142.45 -167.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.875 179.97 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.427 HG23 ' C ' ' A' ' 48' ' ' LEU . 2.8 t 68.17 142.61 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.679 0.276 . . . . 0.0 110.659 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -175.46 66.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.784 0.326 . . . . 0.0 111.229 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -113.98 37.81 3.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.824 179.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.491 ' O ' ' CG ' ' A' ' 52' ' ' ASN . 8.4 t-20 -84.94 15.35 4.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.81 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.446 ' O ' ' C ' ' A' ' 54' ' ' THR . 0.6 OUTLIER -170.48 134.21 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.954 179.949 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.498 HG21 HG23 ' A' ' 86' ' ' THR . 0.2 OUTLIER -34.65 -64.52 0.25 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.035 -179.863 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -157.82 175.72 13.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.002 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -75.83 76.79 2.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.778 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.23 63.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.799 179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.499 HG22 ' HA ' ' A' ' 85' ' ' SER . 0.6 OUTLIER -86.74 143.76 27.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.913 179.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.8 p -147.08 134.75 21.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.957 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.511 ' SG ' ' CB ' ' A' ' 84' ' ' CYS . 83.8 m -88.81 125.05 34.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.315 -179.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.68 ' O ' HG13 ' A' ' 61' ' ' VAL . 11.4 p -126.43 71.12 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.047 179.43 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.64 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 24.54 106.88 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.456 -179.344 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.804 ' N ' ' O ' ' A' ' 81' ' ' ALA . 9.7 ttmm -55.25 -42.66 73.78 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 177.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.512 ' N ' ' HB3' ' A' ' 81' ' ' ALA . 0.7 OUTLIER -136.9 136.81 38.98 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.251 -1.341 . . . . 0.0 108.901 178.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.692 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 6.2 p90 -126.2 160.94 28.87 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.141 0.496 . . . . 0.0 112.264 -178.045 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.89 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 1.2 t30 -126.08 27.03 6.39 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-O 122.51 1.148 . . . . 0.0 107.945 176.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.594 ' HG3' ' HA ' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -9.57 122.94 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 112.466 -2.152 . . . . 0.0 111.367 -179.46 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.958 HG21 ' CD1' ' A' ' 25' ' ' ILE . 2.4 m -119.47 40.81 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.186 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.707 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 48.0 m -18.08 118.39 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.282 -179.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.906 HG22 ' O ' ' A' ' 68' ' ' VAL . 0.2 OUTLIER -131.76 -167.37 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-O 121.608 0.718 . . . . 0.0 112.215 -178.544 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.634 ' H ' HG12 ' A' ' 70' ' ' VAL . 0.0 OUTLIER 42.32 -131.57 0.53 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.755 -179.839 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -83.7 36.5 2.82 Favored Glycine 0 N--CA 1.435 -1.394 0 CA-C-N 115.263 -0.881 . . . . 0.0 112.099 179.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 94.55 47.0 2.84 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.034 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.707 ' O ' ' HA ' ' A' ' 69' ' ' THR . 3.5 m-85 -78.28 178.53 7.57 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.657 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -155.59 110.18 2.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.984 0.421 . . . . 0.0 111.669 -179.876 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.149 HG21 ' CG2' ' A' ' 25' ' ' ILE . 10.1 m -107.5 10.59 9.12 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.416 0 CA-C-O 121.288 0.566 . . . . 0.0 109.686 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.772 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER 28.54 40.12 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 -177.601 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.89 ' HB3' ' CA ' ' A' ' 66' ' ' ASN . 13.9 t-20 5.95 62.26 0.0 OUTLIER 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 -176.105 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 1.182 ' O ' HD21 ' A' ' 12' ' ' LEU . 28.4 m170 -37.17 103.67 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.252 0 CA-C-O 122.409 1.1 . . . . 0.0 112.026 -175.239 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.76 HG23 ' O ' ' A' ' 78' ' ' ASN . 7.8 p -102.44 -5.58 23.92 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 113.777 -1.556 . . . . 0.0 111.32 -178.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.804 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -167.2 135.34 2.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 15.6 m -115.84 155.14 28.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.832 0.349 . . . . 0.0 111.095 -179.109 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.566 ' O ' ' CD2' ' A' ' 83' ' ' HIS . 0.2 OUTLIER -159.78 116.76 2.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.964 0.411 . . . . 0.0 111.075 179.534 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.525 ' O ' ' HB2' ' A' ' 85' ' ' SER . 0.5 OUTLIER -73.48 137.72 44.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.972 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.561 ' OG ' ' N ' ' A' ' 86' ' ' THR . 17.0 t 163.99 -165.78 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.979 179.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.561 ' N ' ' OG ' ' A' ' 85' ' ' SER . 25.1 p -49.65 -178.79 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.064 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 52.6 m -154.12 92.66 1.55 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.687 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -113.79 132.99 55.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.891 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.456 ' O ' ' HB2' ' A' ' 90' ' ' HIS . 0.4 OUTLIER -153.47 -76.16 0.12 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.928 179.804 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.456 ' HB2' ' O ' ' A' ' 89' ' ' TYR . 66.3 t-80 178.69 158.85 0.54 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.163 -179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -95.4 127.59 41.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.993 -179.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.7 t . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.19 -0.91 . . . . 0.0 110.999 180.0 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 0.954 ' H82' HD11 ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.554 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . 0.61 ' O2 ' ' H5 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . 0.61 ' H5 ' ' O2 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . 0.81 ' H3 ' ' O7 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.65 ' H5 ' ' O5 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . 0.65 ' O5 ' ' H5 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.771 ' HB3' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.937 0.398 . . . . 0.0 110.996 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.771 ' CD ' ' HB3' ' A' ' 1' ' ' ALA . 14.9 Cg_exo -35.13 134.51 0.18 Allowed 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 123.217 2.611 . . . . 0.0 112.359 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -106.8 -53.97 2.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.936 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.418 ' C ' ' HG2' ' A' ' 5' ' ' GLN . 0.5 OUTLIER -74.89 151.72 6.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.88 0.371 . . . . 0.0 111.07 179.958 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.418 ' HG2' ' C ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -138.15 -155.05 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.964 -179.594 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.519 ' OD1' ' N ' ' A' ' 6' ' ' ASP . 0.3 OUTLIER -55.42 -170.4 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.688 179.89 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.429 ' C ' ' SG ' ' A' ' 31' ' ' CYS . 12.2 t -178.75 76.28 0.21 Allowed Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.859 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.461 ' HG2' ' HA2' ' A' ' 30' ' ' GLY . 70.2 Cg_endo -74.45 158.76 43.98 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.643 2.229 . . . . 0.0 112.467 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.471 ' HA ' ' CE1' ' A' ' 33' ' ' PHE . 0.3 OUTLIER -49.36 124.33 9.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.888 179.947 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.57 ' HB2' ' C ' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -58.88 126.62 28.42 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.058 -179.901 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.648 ' O ' ' N ' ' A' ' 29' ' ' MET . 9.2 t 176.29 -175.04 0.11 Allowed 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.098 179.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.853 HD23 HD13 ' A' ' 26' ' ' LEU . 4.6 mp -79.76 136.72 36.82 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.554 -179.532 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.629 ' O ' ' O ' ' A' ' 14' ' ' GLU . 42.9 mt-30 -115.39 60.53 0.7 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.212 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.629 ' O ' ' O ' ' A' ' 13' ' ' GLN . 20.9 tt0 2.8 121.2 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.752 -179.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 1.007 ' ND2' HG11 ' A' ' 70' ' ' VAL . 1.5 t-20 -51.71 113.07 3.67 Favored Pre-proline 0 C--N 1.306 -1.311 0 CA-C-N 113.866 -1.515 . . . . 0.0 112.139 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_endo -79.86 18.16 1.18 Allowed 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.418 2.079 . . . . 0.0 111.607 178.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.574 ' CD2' ' SD ' ' A' ' 71' ' ' MET . 15.6 t80 -124.88 -55.28 1.61 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.487 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 1.213 ' CD1' HG12 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -73.03 -16.17 61.5 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.829 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.489 ' HB3' ' O ' ' A' ' 15' ' ' ASN . 4.2 p -49.18 88.05 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.627 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.599 ' O ' ' N ' ' A' ' 22' ' ' GLY . 4.3 mt-30 -113.58 160.21 32.57 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.063 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.14 67.21 0.03 OUTLIER 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.757 2.304 . . . . 0.0 112.19 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.599 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 144.54 -5.45 1.58 Allowed Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.811 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.935 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -153.46 105.32 2.56 Favored Pre-proline 0 CA--C 1.515 -0.376 0 CA-C-O 122.006 0.907 . . . . 0.0 111.858 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.672 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.4 Cg_endo -102.95 68.26 0.03 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.457 0 C-N-CA 124.904 3.736 . . . . 0.0 112.528 -179.332 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.216 ' CG2' HG21 ' A' ' 76' ' ' VAL . 24.4 mm -39.82 -174.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -179.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.035 HD23 ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -153.63 -159.21 0.95 Allowed 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -174.858 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.492 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 1.9 tt0 160.16 101.61 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 112.661 -2.063 . . . . 0.0 110.062 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.55 ' HA ' ' HA ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -47.11 103.71 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.115 -179.005 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.648 ' N ' ' O ' ' A' ' 11' ' ' THR . 0.6 OUTLIER -120.23 140.77 50.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.935 179.726 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.461 ' HA2' ' HG2' ' A' ' 8' ' ' PRO . . . 134.38 -135.88 8.25 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.711 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.57 ' C ' ' HB2' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -158.87 136.29 10.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.795 0.331 . . . . 0.0 110.908 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 50.5 t -73.41 73.66 1.38 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.34 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.471 ' CE1' ' HA ' ' A' ' 9' ' ' GLU . 24.1 p90 -121.23 -173.9 2.72 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.62 179.599 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -173.85 148.96 1.49 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.896 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.3 mmt85 -40.96 131.83 2.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.775 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.485 ' O ' ' CB ' ' A' ' 37' ' ' TYR . . . -74.28 117.05 15.65 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.108 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.485 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 5.8 t80 161.87 123.4 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.738 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.453 ' O ' ' C ' ' A' ' 39' ' ' THR . 10.2 Cg_endo -53.42 170.69 0.35 Allowed 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.775 2.316 . . . . 0.0 112.098 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.453 ' C ' ' O ' ' A' ' 38' ' ' PRO . 81.7 p 33.84 64.77 1.51 Allowed Pre-proline 0 C--N 1.331 -0.214 0 CA-C-O 121.076 0.465 . . . . 0.0 110.524 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -71.82 173.52 12.58 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.86 2.373 . . . . 0.0 112.69 -179.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.46 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 4.0 mm? -61.92 121.25 12.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.918 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.46 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -151.25 72.58 1.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.98 -179.798 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 30.6 t -166.02 -94.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.633 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.49 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -54.88 104.83 0.13 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.142 179.409 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.868 ' HG2' HG22 ' A' ' 46' ' ' THR . 10.9 ttpt -179.88 -30.03 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.182 -179.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.868 HG22 ' HG2' ' A' ' 45' ' ' LYS . 0.2 OUTLIER 175.07 -35.39 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.729 -179.987 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -165.08 168.47 17.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.818 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.463 HD23 ' HA ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -85.77 79.67 9.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.814 0.34 . . . . 0.0 111.08 179.956 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.451 ' O ' ' O ' ' A' ' 48' ' ' LEU . 31.5 t 56.44 151.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.168 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.454 ' O ' ' C ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -129.53 156.42 44.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.707 179.88 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.454 ' C ' ' O ' ' A' ' 50' ' ' GLN . 0.2 OUTLIER -33.09 115.47 0.2 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.886 179.985 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -79.25 -167.42 1.18 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.506 ' O ' ' C ' ' A' ' 54' ' ' THR . 0.3 OUTLIER -144.86 112.58 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.628 179.908 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.608 HG23 ' H ' ' A' ' 55' ' ' SER . 3.1 t -26.04 -58.94 0.08 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.414 -179.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.608 ' H ' HG23 ' A' ' 54' ' ' THR . 1.4 t 155.83 121.01 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.927 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.486 ' N ' ' OE1' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -150.58 83.73 1.36 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.806 179.869 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 62.74 -152.35 0.35 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.812 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.655 ' O ' ' CB ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER 179.4 -177.09 0.3 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.063 179.944 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.726 ' O ' HG22 ' A' ' 61' ' ' VAL . 27.3 t 107.33 132.92 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.893 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.2 m -55.32 121.48 9.0 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.008 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.726 HG22 ' O ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER -146.83 76.17 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.57 179.872 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.661 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . -5.71 102.73 0.01 OUTLIER 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 122.071 0.938 . . . . 0.0 112.317 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.858 ' HG3' ' C ' ' A' ' 81' ' ' ALA . 0.1 OUTLIER -50.8 -44.85 59.05 Favored 'General case' 0 CA--C 1.49 -1.33 0 CA-C-N 113.613 -1.63 . . . . 0.0 108.597 178.028 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.678 ' O ' ' N ' ' A' ' 80' ' ' THR . 37.2 m -138.96 112.48 8.25 Favored 'General case' 0 N--CA 1.425 -1.677 0 CA-C-N 113.625 -1.625 . . . . 0.0 110.395 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.696 ' CG ' ' CG ' ' A' ' 77' ' ' GLU . 0.9 OUTLIER -99.66 164.25 12.14 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.843 -178.823 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.795 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -134.65 29.16 3.56 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 177.317 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.563 ' O ' ' O ' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -6.18 129.98 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 112.099 -2.319 . . . . 0.0 112.487 -179.678 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 1.049 HG21 HG13 ' A' ' 25' ' ' ILE . 3.2 m -141.04 47.31 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.593 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.677 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 20.1 m -6.92 118.64 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.138 -179.075 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 1.213 HG12 ' CD1' ' A' ' 18' ' ' PHE . 5.4 m -119.01 -169.48 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.867 0.841 . . . . 0.0 112.851 -178.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.593 ' HG2' HG23 ' A' ' 70' ' ' VAL . 3.0 mmt 34.51 -127.86 0.09 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.212 -1.358 . . . . 0.0 111.517 179.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -83.02 35.81 2.73 Favored Glycine 0 N--CA 1.44 -1.06 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.585 -179.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.527 ' C ' HG23 ' A' ' 69' ' ' THR . . . 103.33 19.24 12.74 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.869 -0.682 . . . . 0.0 112.027 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.738 ' HB2' ' CG2' ' A' ' 70' ' ' VAL . 3.0 m-85 -52.03 -176.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.656 0.265 . . . . 0.0 111.038 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.582 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 18.9 mtmm -153.36 94.85 1.86 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.902 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.216 HG21 ' CG2' ' A' ' 25' ' ' ILE . 31.7 m -86.44 10.77 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.49 -1.359 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.633 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.727 ' O ' ' HD2' ' A' ' 79' ' ' HIS . 0.1 OUTLIER 26.46 42.01 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 105.666 -1.975 . . . . 0.0 105.666 -177.632 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.95 ' HB2' HG13 ' A' ' 68' ' ' VAL . 51.6 t30 -0.86 69.98 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.846 0 CA-C-N 113.51 -1.677 . . . . 0.0 109.16 -174.209 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 1.031 ' N ' HD12 ' A' ' 26' ' ' LEU . 41.3 m170 -43.34 111.76 0.31 Allowed 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 113.472 -1.694 . . . . 0.0 113.5 -176.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.678 ' N ' ' O ' ' A' ' 64' ' ' SER . 1.5 p -91.71 -33.58 14.98 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 113.731 -1.577 . . . . 0.0 108.413 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.858 ' C ' ' HG3' ' A' ' 63' ' ' LYS . . . -149.55 150.04 31.64 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 177.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.9 OUTLIER -129.35 130.41 46.04 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.075 0.464 . . . . 0.0 111.674 -179.612 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.645 ' HB3' ' HD2' ' A' ' 63' ' ' LYS . 0.4 OUTLIER -131.99 131.38 42.49 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.615 -179.718 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 66.6 m -65.24 102.07 0.62 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.222 178.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.559 ' N ' ' O ' ' A' ' 59' ' ' CYS . 0.7 OUTLIER -156.2 174.7 15.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.728 -179.616 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.514 ' O ' HG11 ' A' ' 61' ' ' VAL . 0.5 OUTLIER -33.93 129.12 0.35 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.153 -179.922 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.426 ' CB ' HG13 ' A' ' 61' ' ' VAL . 1.0 OUTLIER -146.41 161.92 39.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.855 -179.998 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -103.36 143.91 32.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.734 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 11.2 m-30 -69.76 57.5 0.14 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.861 0.362 . . . . 0.0 110.836 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.591 ' O ' ' C ' ' A' ' 91' ' ' LYS . 1.3 t-160 -109.01 -53.21 2.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.705 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.591 ' C ' ' O ' ' A' ' 90' ' ' HIS . 0.0 OUTLIER -1.44 72.86 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.908 179.938 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.541 ' N ' ' O ' ' A' ' 90' ' ' HIS . 16.8 m . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.769 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 0.935 ' H83' ' HB1' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.757 ' O7 ' ' C3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . 0.595 ' H4 ' ' O5 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . 0.499 ' H3 ' ' O4 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . 0.595 ' O5 ' ' H4 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . 0.733 ' C3 ' ' O7 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.683 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . 0.683 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.892 0.377 . . . . 0.0 110.951 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -77.68 97.38 1.14 Allowed 'Trans proline' 0 N--CA 1.464 -0.224 0 C-N-CA 122.769 2.313 . . . . 0.0 112.251 179.997 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -120.61 163.71 17.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.756 179.868 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.51 ' O ' ' N ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -127.39 70.13 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.224 -179.845 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' A' ' 5' ' ' GLN . 12.9 pt20 -64.01 64.0 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.713 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.528 ' OD1' ' N ' ' A' ' 6' ' ' ASP . 4.9 p-10 -177.55 101.93 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.839 -179.81 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.463 ' N ' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER 34.28 60.31 2.08 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.114 179.968 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.605 ' O ' ' CA ' ' A' ' 30' ' ' GLY . 52.3 Cg_exo -54.06 107.17 0.2 Allowed 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 122.345 2.03 . . . . 0.0 111.612 179.53 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.484 ' C ' ' O ' ' A' ' 8' ' ' PRO . 7.6 tt0 -28.33 116.25 0.09 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.407 -179.631 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.537 ' HA ' ' HA3' ' A' ' 30' ' ' GLY . 1.8 t -48.12 118.96 2.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.575 179.965 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.43 ' OG1' ' O ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER 176.06 162.14 0.34 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.218 -179.538 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.888 HD21 ' O ' ' A' ' 79' ' ' HIS . 6.0 mp -54.66 130.86 41.92 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.977 178.912 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.671 ' O ' ' O ' ' A' ' 14' ' ' GLU . 1.8 mm-40 -127.57 62.31 1.38 Allowed 'General case' 0 CA--C 1.506 -0.727 0 CA-C-O 122.357 1.075 . . . . 0.0 111.734 -179.853 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.686 ' O ' ' HD3' ' A' ' 16' ' ' PRO . 0.9 OUTLIER 6.46 125.87 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 112.241 -2.254 . . . . 0.0 112.295 179.538 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.772 ' ND2' HG11 ' A' ' 76' ' ' VAL . 0.5 OUTLIER -56.15 100.2 0.21 Allowed Pre-proline 0 C--N 1.314 -0.944 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.889 179.782 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.686 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 66.0 Cg_endo -72.86 4.81 3.35 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 121.738 1.625 . . . . 0.0 109.315 177.342 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.542 ' CD2' ' CE1' ' A' ' 18' ' ' PHE . 1.1 t80 -106.02 -57.87 1.99 Allowed 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 113.724 -1.58 . . . . 0.0 110.364 -179.839 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.945 ' CG ' HG21 ' A' ' 70' ' ' VAL . 3.6 m-30 -81.58 0.67 37.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.622 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.49 102.95 0.6 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.012 179.899 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.607 ' HB3' ' HD2' ' A' ' 21' ' ' PRO . 12.9 mt-30 -111.54 162.21 22.02 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.286 179.607 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.607 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 24.9 Cg_endo -60.47 66.37 0.08 OUTLIER 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.647 2.232 . . . . 0.0 111.812 179.773 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.537 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 147.14 -10.96 1.37 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.345 -179.623 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 1.105 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -146.89 106.38 3.95 Favored Pre-proline 0 CA--C 1.514 -0.441 0 CA-C-O 121.858 0.837 . . . . 0.0 111.349 -179.662 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.569 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 97.3 Cg_endo -104.03 75.44 0.03 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.573 0 C-N-CA 124.752 3.634 . . . . 0.0 113.083 -178.48 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.268 ' CG2' HG21 ' A' ' 76' ' ' VAL . 15.5 mm -44.47 -175.35 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.911 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.003 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -146.04 -166.36 2.44 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 -176.026 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.534 ' O ' ' C ' ' A' ' 28' ' ' CYS . 0.0 OUTLIER 164.32 75.17 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 112.501 -2.136 . . . . 0.0 111.993 178.735 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.707 ' SG ' HD12 ' A' ' 12' ' ' LEU . 14.1 m -23.53 101.0 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.709 179.211 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.3 ttt -119.22 146.85 44.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.894 -179.388 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.605 ' CA ' ' O ' ' A' ' 8' ' ' PRO . . . 144.3 -163.06 27.87 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.929 179.846 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.416 ' O ' ' SG ' ' A' ' 31' ' ' CYS . 6.9 p -128.03 124.77 37.96 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.811 0.338 . . . . 0.0 110.786 -179.812 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.6 t -79.19 123.65 27.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.768 179.985 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -157.97 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.748 179.868 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.529 ' O ' ' C ' ' A' ' 35' ' ' ARG . 26.0 p -104.12 59.72 0.72 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.575 179.656 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.529 ' C ' ' O ' ' A' ' 34' ' ' SER . 2.8 tmm_? -24.5 133.72 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.228 -179.712 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -116.71 115.81 26.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.861 179.813 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER 60.44 85.86 0.17 Allowed Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.838 -179.972 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.441 ' HD3' ' NH1' ' A' ' 35' ' ' ARG . 94.2 Cg_exo -43.05 137.78 4.45 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.694 2.263 . . . . 0.0 112.324 179.952 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 62.3 p -52.52 152.02 6.98 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.139 -179.742 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.8 164.21 32.26 Favored 'Trans proline' 0 N--CA 1.465 -0.155 0 C-N-CA 122.925 2.417 . . . . 0.0 112.408 -179.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.493 ' O ' ' O ' ' A' ' 42' ' ' ARG . 1.3 pp -162.83 -26.42 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.171 179.803 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.493 ' O ' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -45.32 178.88 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.764 0.316 . . . . 0.0 110.851 -179.97 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.463 ' OG ' ' N ' ' A' ' 44' ' ' LYS . 87.0 p -118.32 -99.31 0.44 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.338 -179.809 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.463 ' N ' ' OG ' ' A' ' 43' ' ' SER . 3.5 ttmt -132.02 41.14 3.28 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.761 0.315 . . . . 0.0 111.174 -179.696 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.583 ' C ' HG22 ' A' ' 46' ' ' THR . 9.1 ttmt 66.06 174.67 0.23 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.931 179.753 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.64 ' OG1' ' N ' ' A' ' 47' ' ' MET . 0.1 OUTLIER 178.2 -169.34 0.09 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.842 -179.994 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.64 ' N ' ' OG1' ' A' ' 46' ' ' THR . 0.0 OUTLIER -34.91 160.33 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.12 179.914 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.448 ' C ' ' O ' ' A' ' 47' ' ' MET . 1.2 tt -30.88 129.93 0.12 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.406 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.9 m -97.61 144.57 10.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.056 179.733 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.31 -172.23 2.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.868 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.9 tttt -97.89 141.1 31.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.927 -179.827 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.543 ' N ' ' ND2' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -163.95 94.55 0.75 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.723 179.907 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 5.6 p -160.24 139.45 3.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.284 -179.852 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.423 ' O ' ' CB ' ' A' ' 55' ' ' SER . 73.3 p -65.98 -82.94 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.963 179.86 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.423 ' CB ' ' O ' ' A' ' 54' ' ' THR . 6.2 p 166.03 -166.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.424 -179.862 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -72.37 55.75 0.34 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.792 0.33 . . . . 0.0 110.916 179.869 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.1 p -147.74 122.8 10.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.724 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.437 HG22 ' HB2' ' A' ' 85' ' ' SER . 0.0 OUTLIER -130.71 156.95 44.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.119 -179.732 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.431 ' SG ' ' C ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -172.11 139.98 1.14 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.752 179.69 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.443 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 96.6 m -70.91 126.21 28.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.324 -179.604 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.761 HG22 ' O ' ' A' ' 61' ' ' VAL . 2.2 p -143.72 65.52 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.214 179.331 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.594 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 10.64 104.29 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.073 -179.224 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 1.046 ' N ' ' O ' ' A' ' 81' ' ' ALA . 70.4 tttt -53.35 -36.29 61.18 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 178.148 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.468 ' N ' ' HB3' ' A' ' 81' ' ' ALA . 8.0 m -139.08 163.01 33.54 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.326 -1.306 . . . . 0.0 108.558 178.867 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.764 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.7 OUTLIER -144.57 159.29 43.04 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.616 -179.236 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.878 ' CA ' ' HB3' ' A' ' 78' ' ' ASN . 0.9 OUTLIER -124.28 24.83 7.94 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 122.677 1.227 . . . . 0.0 107.817 176.88 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.551 ' O ' ' O ' ' A' ' 66' ' ' ASN . 3.9 ttt180 1.0 121.53 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 111.997 -2.365 . . . . 0.0 112.04 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 1.003 HG21 ' CD1' ' A' ' 25' ' ' ILE . 1.5 m -128.27 39.81 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.893 179.668 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.664 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 47.8 m -21.45 118.61 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.062 -179.454 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.945 HG21 ' CG ' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -121.29 -168.87 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.775 0.797 . . . . 0.0 112.636 -178.767 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.473 ' HB2' ' CD2' ' A' ' 74' ' ' PHE . 61.0 mmm 30.17 -131.45 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.127 -1.397 . . . . 0.0 111.571 -179.918 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -63.04 -0.39 3.03 Favored Glycine 0 N--CA 1.442 -0.923 0 CA-C-N 115.342 -0.845 . . . . 0.0 113.271 -179.694 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.532 ' N ' ' O ' ' A' ' 70' ' ' VAL . . . 119.62 37.11 0.8 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.156 -179.782 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.664 ' O ' ' HA ' ' A' ' 69' ' ' THR . 32.2 m-85 -64.08 -178.67 0.36 Allowed 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.498 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.619 ' HG3' ' O ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -153.87 95.13 1.84 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -179.576 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.268 HG21 ' CG2' ' A' ' 25' ' ' ILE . 14.1 m -92.15 16.89 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.494 -1.201 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.323 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.764 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 22.38 45.12 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 -177.934 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.878 ' HB3' ' CA ' ' A' ' 66' ' ' ASN . 9.0 t-20 3.16 71.13 0.0 OUTLIER 'General case' 0 CA--C 1.498 -1.041 0 CA-C-N 114.407 -1.269 . . . . 0.0 107.601 -175.226 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 1.003 ' N ' HD12 ' A' ' 26' ' ' LEU . 33.2 m170 -41.99 115.06 0.61 Allowed 'General case' 0 C--N 1.304 -1.383 0 CA-C-O 122.372 1.082 . . . . 0.0 111.475 -176.277 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.786 HG23 ' O ' ' A' ' 78' ' ' ASN . 11.0 p -114.02 -2.83 13.42 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 113.779 -1.555 . . . . 0.0 110.761 -178.578 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 1.046 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -168.35 112.48 0.61 Allowed 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.79 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.525 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 0.5 OUTLIER -99.87 153.96 18.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.692 0.282 . . . . 0.0 110.838 -179.284 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.738 ' NE2' HG13 ' A' ' 61' ' ' VAL . 1.6 p80 -161.69 113.59 1.75 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.942 0.401 . . . . 0.0 111.092 -179.975 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.684 ' O ' ' CB ' ' A' ' 85' ' ' SER . 0.1 OUTLIER -72.41 111.12 7.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.701 179.946 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.684 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 13.5 t 136.9 164.75 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.095 179.942 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.407 ' CB ' ' O ' ' A' ' 85' ' ' SER . 3.2 m 77.78 69.16 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.118 179.875 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 1.6 m -117.04 135.78 53.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.273 -179.923 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 5.0 m-30 -89.91 49.76 1.77 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.405 179.477 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -169.29 -177.3 2.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.3 -179.724 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.515 ' CD2' ' HD2' ' A' ' 91' ' ' LYS . 0.0 OUTLIER -147.63 119.86 8.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.92 0.39 . . . . 0.0 111.113 -179.878 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.515 ' HD2' ' CD2' ' A' ' 90' ' ' HIS . 0.0 OUTLIER 64.59 79.06 0.27 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.086 179.881 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 71.1 m . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.715 179.828 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 1.105 ' H83' ' HB1' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.576 ' O7 ' ' O4 ' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . 0.997 ' H62' ' H5 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . 0.575 ' O2 ' ' O7 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . 0.997 ' H5 ' ' H62' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . 0.865 ' H4 ' ' O2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.575 ' O7 ' ' O2 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . 0.574 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . 0.865 ' O2 ' ' H4 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.456 ' HB1' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.867 0.365 . . . . 0.0 110.921 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.597 ' O ' ' C ' ' A' ' 3' ' ' ASP . 20.7 Cg_exo -65.53 -156.48 0.03 OUTLIER 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.87 2.38 . . . . 0.0 111.98 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.597 ' C ' ' O ' ' A' ' 2' ' ' PRO . 0.4 OUTLIER 4.82 110.09 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.684 179.854 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.588 HG12 ' H ' ' A' ' 6' ' ' ASP . 89.7 t -100.14 144.44 12.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.108 0.48 . . . . 0.0 111.805 -179.544 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.464 ' O ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -136.31 36.6 2.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.142 179.473 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.588 ' H ' HG12 ' A' ' 4' ' ' VAL . 0.2 OUTLIER -53.35 -158.38 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.493 -179.401 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.484 ' C ' ' O ' ' A' ' 6' ' ' ASP . 1.2 p -25.25 144.82 0.03 OUTLIER Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.87 -179.567 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -57.81 -157.73 0.01 OUTLIER 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 123.154 2.569 . . . . 0.0 112.515 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.963 ' O ' HG22 ' A' ' 11' ' ' THR . 2.3 tt0 -89.81 130.48 36.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.32 -179.737 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.414 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -32.49 130.45 0.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.547 179.987 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.963 HG22 ' O ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -170.34 -160.42 0.22 Allowed 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.157 179.201 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.281 HD21 ' O ' ' A' ' 79' ' ' HIS . 0.8 OUTLIER -74.98 135.77 41.33 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.462 -179.224 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.635 ' O ' ' O ' ' A' ' 14' ' ' GLU . 6.8 mt-30 -122.18 54.15 1.19 Allowed 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 121.715 0.769 . . . . 0.0 109.707 177.808 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.635 ' O ' ' O ' ' A' ' 13' ' ' GLN . 5.0 tt0 -2.93 125.66 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 113.495 -1.684 . . . . 0.0 111.445 -178.546 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.754 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.5 OUTLIER -62.16 106.0 0.74 Allowed Pre-proline 0 C--N 1.309 -1.173 0 CA-C-N 114.335 -1.302 . . . . 0.0 112.274 -179.176 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.407 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 4.3 Cg_exo -77.19 10.88 2.25 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 122.531 2.154 . . . . 0.0 109.415 177.453 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.564 ' CE1' ' SD ' ' A' ' 71' ' ' MET . 0.9 OUTLIER -106.48 -61.15 1.56 Allowed 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.138 -1.392 . . . . 0.0 111.296 -179.196 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.811 ' CG ' HG21 ' A' ' 70' ' ' VAL . 5.2 m-85 -81.72 -3.22 53.14 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.714 -178.718 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.707 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 58.4 p -58.75 89.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.974 0.416 . . . . 0.0 110.723 -179.886 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.589 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -88.57 165.99 25.18 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.933 179.731 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.453 ' CD ' ' HG3' ' A' ' 20' ' ' GLN . 22.6 Cg_endo -61.43 59.02 0.11 Allowed 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 122.348 2.032 . . . . 0.0 111.452 179.638 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.589 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 157.39 -16.53 0.34 Allowed Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 115.773 -0.648 . . . . 0.0 112.622 -179.534 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 1.14 ' CB ' ' H83' ' A' ' 178' ' ' NAG . . . -145.22 109.25 4.6 Favored Pre-proline 0 CA--C 1.517 -0.324 0 CA-C-O 121.966 0.889 . . . . 0.0 112.168 -179.316 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.89 ' HD2' ' H3 ' ' A' ' 178' ' ' NAG . 69.0 Cg_endo -101.81 78.81 0.04 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.284 0 C-N-CA 124.912 3.741 . . . . 0.0 113.401 -179.086 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.185 ' CG2' HG21 ' A' ' 76' ' ' VAL . 5.6 mm -39.18 -176.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.992 HD13 ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -152.98 -160.12 1.09 Allowed 'General case' 0 CA--C 1.503 -0.856 0 CA-C-O 122.509 1.147 . . . . 0.0 113.955 -175.974 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.565 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 14.2 tt0 162.75 78.24 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 112.853 -1.976 . . . . 0.0 111.339 179.392 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.802 ' HA ' ' O ' ' A' ' 11' ' ' THR . 77.1 m -25.52 100.24 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.174 179.885 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.831 ' N ' ' O ' ' A' ' 11' ' ' THR . 1.0 OUTLIER -136.07 146.08 46.67 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.942 179.8 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.76 -151.23 20.95 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.591 -179.971 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.438 ' SG ' ' O ' ' A' ' 31' ' ' CYS . 31.4 p -147.73 80.5 1.49 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.726 0.298 . . . . 0.0 110.936 179.99 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.574 ' O ' ' CD1' ' A' ' 33' ' ' PHE . 0.3 OUTLIER -37.78 -83.59 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.869 179.815 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 32' ' ' CYS . 35.7 m-85 -162.23 -38.51 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.961 -179.847 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.604 ' O ' HG23 ' A' ' 58' ' ' THR . 0.0 OUTLIER -111.54 116.97 31.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.941 179.883 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.436 ' O ' ' O ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -118.89 -162.21 0.89 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.997 179.836 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.436 ' O ' ' O ' ' A' ' 35' ' ' ARG . . . 45.35 -174.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.115 -179.808 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.582 ' O ' ' CD1' ' A' ' 37' ' ' TYR . 0.4 OUTLIER -102.78 124.42 38.95 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.847 179.937 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.93 179.67 0.71 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.781 2.32 . . . . 0.0 112.391 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.459 ' O ' ' OG1' ' A' ' 39' ' ' THR . 0.1 OUTLIER -114.97 101.13 54.44 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.875 179.965 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -87.5 -161.29 0.12 Allowed 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.082 2.521 . . . . 0.0 112.06 179.819 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.517 ' O ' ' N ' ' A' ' 43' ' ' SER . 4.8 mt -107.44 27.5 9.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.912 179.95 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.446 ' HD2' ' C ' ' A' ' 41' ' ' LEU . 0.8 OUTLIER 61.48 -73.71 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.993 0.425 . . . . 0.0 110.592 -179.899 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.523 ' O ' ' CB ' ' A' ' 44' ' ' LYS . 0.1 OUTLIER 51.14 -157.43 0.11 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.281 179.642 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' A' ' 43' ' ' SER . 0.1 OUTLIER 86.65 57.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.566 -179.634 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.423 ' H ' ' HG3' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -68.74 -157.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.876 -179.876 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.4 78.9 1.65 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.832 179.826 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -170.13 130.11 0.94 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.001 -179.861 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.69 74.82 2.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.212 -179.8 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.51 HG22 ' O ' ' A' ' 49' ' ' VAL . 0.7 OUTLIER -116.18 120.11 63.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.659 179.691 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.44 ' HG2' ' C ' ' A' ' 49' ' ' VAL . 0.1 OUTLIER -148.27 145.43 28.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.941 0.4 . . . . 0.0 111.194 -179.885 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.448 ' HB2' ' CG2' ' A' ' 53' ' ' VAL . 7.2 mmtp -137.81 23.53 2.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.78 179.9 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 54.7 36.44 26.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.735 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.457 ' O ' HG23 ' A' ' 54' ' ' THR . 1.5 t -96.82 162.51 2.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.95 179.92 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 53' ' ' VAL . 0.0 OUTLIER 176.36 -169.43 0.06 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.869 179.969 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.506 ' O ' ' O ' ' A' ' 56' ' ' GLU . 8.6 m -144.6 -57.4 0.36 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.984 -179.911 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.506 ' O ' ' O ' ' A' ' 55' ' ' SER . 1.0 OUTLIER 49.58 109.46 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.506 -179.709 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.486 ' C ' ' O ' ' A' ' 56' ' ' GLU . 0.3 OUTLIER -31.05 -82.83 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.837 -179.836 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.604 HG23 ' O ' ' A' ' 34' ' ' SER . 4.7 p -76.53 -177.28 4.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.538 179.597 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.645 ' O ' ' O ' ' A' ' 83' ' ' HIS . 1.8 t -152.62 28.28 0.55 Allowed 'General case' 0 CA--C 1.508 -0.642 0 CA-C-O 121.572 0.701 . . . . 0.0 111.356 -179.927 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.697 ' O ' HG23 ' A' ' 61' ' ' VAL . 33.5 m -62.5 -167.33 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.371 -1.286 . . . . 0.0 110.617 179.488 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.79 HG12 ' O ' ' A' ' 61' ' ' VAL . 56.7 t 116.45 62.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.041 -179.535 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.818 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 10.23 108.36 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.514 -0.766 . . . . 0.0 112.196 -179.621 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.821 ' N ' ' O ' ' A' ' 81' ' ' ALA . 36.5 tttt -51.81 -33.36 35.41 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.582 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.54 ' O ' ' HB1' ' A' ' 62' ' ' ALA . 13.8 m -141.3 165.3 27.89 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.943 179.075 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.656 ' CB ' ' O ' ' A' ' 77' ' ' GLU . 0.3 OUTLIER -147.22 161.83 40.14 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.239 0.542 . . . . 0.0 111.936 -179.356 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.806 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.1 OUTLIER -134.5 29.59 3.57 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-O 122.74 1.257 . . . . 0.0 107.698 176.787 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.555 ' CA ' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -9.76 128.73 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 112.029 -2.35 . . . . 0.0 112.163 -179.458 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 1.038 HG21 ' CD1' ' A' ' 25' ' ' ILE . 4.3 m -136.06 48.35 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 114.812 -1.086 . . . . 0.0 110.282 179.883 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.605 ' C ' ' O ' ' A' ' 68' ' ' VAL . 89.1 m -20.08 118.27 0.03 OUTLIER 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.048 -179.304 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.811 HG21 ' CG ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -120.48 -172.05 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-O 121.428 0.632 . . . . 0.0 112.525 -178.039 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.564 ' SD ' ' CE1' ' A' ' 17' ' ' PHE . 29.0 mmm 33.2 -127.64 0.06 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.791 -1.095 . . . . 0.0 111.147 -179.275 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -78.71 9.88 34.38 Favored Glycine 0 N--CA 1.438 -1.218 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.651 -179.817 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.555 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 128.68 24.76 1.08 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.763 179.969 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.567 ' O ' ' HA ' ' A' ' 69' ' ' THR . 5.7 m-30 -69.7 118.49 12.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.796 0.331 . . . . 0.0 110.999 -179.791 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.442 ' HB3' ' CD ' ' A' ' 67' ' ' ARG . 0.4 OUTLIER -105.87 110.64 23.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.071 0.462 . . . . 0.0 111.892 -179.668 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.185 HG21 ' CG2' ' A' ' 25' ' ' ILE . 17.7 m -95.21 12.05 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.439 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.44 178.958 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.72 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER 29.69 39.34 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 105.47 -2.048 . . . . 0.0 105.47 -176.636 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.874 ' C ' HD12 ' A' ' 26' ' ' LEU . 55.3 t30 3.11 64.11 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.682 0 CA-C-N 113.341 -1.754 . . . . 0.0 108.405 -174.562 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 1.281 ' O ' HD21 ' A' ' 12' ' ' LEU . 35.8 m170 -38.0 114.05 0.32 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 113.399 -1.728 . . . . 0.0 112.818 -176.689 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.54 ' OG1' ' CB ' ' A' ' 64' ' ' SER . 3.0 p -98.54 -7.3 28.53 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 114.388 -1.278 . . . . 0.0 110.339 -179.734 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.821 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -169.32 136.8 1.8 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.89 178.741 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.915 ' SG ' HD12 ' A' ' 12' ' ' LEU . 6.9 m -119.67 119.37 33.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.653 0.263 . . . . 0.0 110.636 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.645 ' O ' ' O ' ' A' ' 59' ' ' CYS . 0.5 OUTLIER -109.2 106.7 16.67 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.917 0.389 . . . . 0.0 110.156 178.996 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.499 ' HB2' ' SG ' ' A' ' 60' ' ' CYS . 15.5 t -123.99 163.43 21.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.007 -179.387 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.633 ' O ' ' C ' ' A' ' 86' ' ' THR . 0.0 OUTLIER 66.47 -175.91 0.19 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.305 -179.759 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.633 ' C ' ' O ' ' A' ' 85' ' ' SER . 11.9 m 7.67 85.64 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.299 179.841 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.668 ' O ' ' HB2' ' A' ' 88' ' ' TYR . 59.9 m -65.38 59.53 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.961 0.41 . . . . 0.0 110.823 -179.725 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.668 ' HB2' ' O ' ' A' ' 87' ' ' CYS . 17.9 t80 156.21 21.96 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.4 179.889 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.611 ' CG ' ' O ' ' A' ' 89' ' ' TYR . 1.2 p90 -48.14 111.31 0.43 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.982 -179.703 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.494 ' O ' ' HB3' ' A' ' 91' ' ' LYS . 7.2 t-160 -64.06 -74.94 0.09 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.695 179.91 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.494 ' HB3' ' O ' ' A' ' 90' ' ' HIS . 0.0 OUTLIER 166.63 -37.58 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.113 -179.998 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.759 179.879 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 1.14 ' H83' ' CB ' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.565 ' O7 ' ' O3 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . 0.44 ' H3 ' ' O7 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.672 ' H4 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . 0.672 ' O2 ' ' H4 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.876 ' HB3' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.487 1.407 0 CA-C-O 120.705 0.288 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.876 ' CD ' ' HB3' ' A' ' 1' ' ' ALA . 1.4 Cg_endo -43.4 -54.06 3.83 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.864 2.376 . . . . 0.0 111.999 179.751 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.587 ' CB ' ' O ' ' A' ' 2' ' ' PRO . 16.1 t0 94.9 90.55 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.41 179.581 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.675 HG23 ' N ' ' A' ' 5' ' ' GLN . 13.2 m 24.42 -142.43 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.866 179.528 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.675 ' N ' HG23 ' A' ' 4' ' ' VAL . 20.2 tt0 -124.04 62.59 1.08 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.909 -179.78 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.475 ' OD1' ' O ' ' A' ' 6' ' ' ASP . 38.8 p30 -132.41 149.66 52.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.039 179.914 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.453 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 11.2 t -35.75 123.41 0.67 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.874 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.545 ' O ' ' O ' ' A' ' 9' ' ' GLU . 32.0 Cg_exo -58.97 78.55 0.05 OUTLIER 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 123.123 2.549 . . . . 0.0 113.563 -179.121 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.545 ' O ' ' O ' ' A' ' 8' ' ' PRO . 6.9 tt0 48.59 162.75 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.155 0.502 . . . . 0.0 112.013 178.65 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.424 ' SG ' ' HA2' ' A' ' 30' ' ' GLY . 11.3 t -56.71 132.29 51.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.171 179.943 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.67 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -149.16 -148.18 0.25 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.624 179.673 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.947 HD23 HD13 ' A' ' 26' ' ' LEU . 3.3 mp -116.21 141.23 48.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.002 0.43 . . . . 0.0 111.034 179.825 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.735 ' CG ' ' HA ' ' A' ' 29' ' ' MET . 1.3 mt-30 -98.93 45.75 1.0 Allowed 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 121.292 0.568 . . . . 0.0 110.896 179.778 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.653 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 0.9 OUTLIER -5.92 117.92 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.835 -178.729 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.796 ' H ' ' C ' ' A' ' 25' ' ' ILE . 0.5 OUTLIER -58.26 103.53 0.37 Allowed Pre-proline 0 C--N 1.304 -1.378 0 CA-C-N 114.063 -1.426 . . . . 0.0 112.455 -178.659 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.558 ' HD3' ' O ' ' A' ' 14' ' ' GLU . 86.2 Cg_endo -77.4 4.36 5.99 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 122.119 1.879 . . . . 0.0 109.289 177.4 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.607 ' CE2' ' SD ' ' A' ' 71' ' ' MET . 0.8 OUTLIER -95.08 -64.41 1.07 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 113.659 -1.61 . . . . 0.0 109.742 179.563 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.831 ' CG ' HG21 ' A' ' 70' ' ' VAL . 7.8 m-85 -74.82 -4.4 37.55 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.994 179.339 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.61 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -57.69 88.57 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.542 179.856 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.723 ' O ' ' N ' ' A' ' 22' ' ' GLY . 0.8 OUTLIER -95.3 155.9 38.3 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.057 179.715 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -48.98 69.04 0.02 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.726 2.284 . . . . 0.0 111.754 179.709 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.723 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 137.25 -0.45 2.87 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.77 -179.572 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 1.023 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -153.94 104.39 2.47 Favored Pre-proline 0 CA--C 1.517 -0.311 0 CA-C-O 121.806 0.812 . . . . 0.0 112.178 -179.551 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.622 ' HD2' ' H3 ' ' A' ' 178' ' ' NAG . 63.2 Cg_endo -104.64 76.64 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 125.133 3.889 . . . . 0.0 113.491 -178.725 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.167 ' CG2' HG21 ' A' ' 76' ' ' VAL . 10.1 mm -40.64 -173.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 179.728 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.027 HD23 ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -151.51 -162.73 1.59 Allowed 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -176.298 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.648 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 35.7 tp60 168.18 50.97 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 113.099 -1.864 . . . . 0.0 111.967 179.55 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.605 ' O ' ' O ' ' A' ' 27' ' ' GLN . 0.8 OUTLIER 26.55 119.14 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 178.705 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.735 ' HA ' ' CG ' ' A' ' 13' ' ' GLN . 1.9 ttp -68.0 -67.97 0.42 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.304 177.921 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.424 ' HA2' ' SG ' ' A' ' 10' ' ' CYS . . . 85.95 100.54 0.74 Allowed Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.931 -0.652 . . . . 0.0 113.205 179.425 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' A' ' 33' ' ' PHE . 11.2 p -162.3 54.44 0.22 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.956 0.408 . . . . 0.0 110.173 179.494 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.2 m -62.88 64.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.991 -179.661 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.535 ' N ' ' O ' ' A' ' 31' ' ' CYS . 15.2 m-30 49.34 -170.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.949 -179.993 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.499 ' HB2' ' O ' ' A' ' 33' ' ' PHE . 0.1 OUTLIER 81.85 -15.19 0.73 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.545 -179.533 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.46 114.51 24.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.605 179.839 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -134.12 25.63 3.89 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.922 0.391 . . . . 0.0 111.368 -179.8 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.552 ' CD1' ' N ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -93.73 124.85 55.59 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.817 179.849 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.478 ' HB2' ' HD2' ' A' ' 40' ' ' PRO . 71.6 Cg_endo -87.94 167.84 6.86 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 122.921 2.414 . . . . 0.0 112.355 179.982 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.571 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -55.66 -57.46 21.11 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-O 121.869 0.842 . . . . 0.0 110.569 179.713 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.571 ' HD3' ' CB ' ' A' ' 39' ' ' THR . 88.6 Cg_endo -80.56 141.34 13.86 Favored 'Trans proline' 0 C--N 1.325 -0.709 0 C-N-CA 124.182 3.255 . . . . 0.0 112.306 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.507 ' O ' ' C ' ' A' ' 42' ' ' ARG . 0.4 OUTLIER -110.09 169.34 8.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.756 179.996 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.515 ' O ' ' N ' ' A' ' 44' ' ' LYS . 4.6 ttp180 -27.59 103.78 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.987 -179.876 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.477 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 1.5 m -64.16 58.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.017 -179.941 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 42' ' ' ARG . 60.1 mttm -161.82 143.45 11.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.664 -179.839 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.74 -170.16 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.65 179.78 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 38.61 63.54 0.87 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.127 179.772 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.413 ' H ' ' HG2' ' A' ' 47' ' ' MET . 2.0 ptp -95.4 158.08 15.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.052 179.895 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.18 174.35 5.99 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.225 -179.694 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.495 ' CG1' ' N ' ' A' ' 50' ' ' GLN . 2.0 t -143.56 158.05 16.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.085 -179.919 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.495 ' N ' ' CG1' ' A' ' 49' ' ' VAL . 0.1 OUTLIER 71.16 125.4 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.935 179.828 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 0.9 OUTLIER 171.16 116.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.175 179.846 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -157.99 -164.97 1.62 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.879 179.646 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.469 ' O ' ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -148.26 103.38 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.537 -179.936 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.469 ' O ' ' O ' ' A' ' 53' ' ' VAL . 9.0 m 56.1 124.31 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.09 179.661 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.422 ' OG ' ' C ' ' A' ' 54' ' ' THR . 0.0 OUTLIER 176.14 165.58 0.41 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.868 179.91 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.555 ' O ' ' CB ' ' A' ' 57' ' ' SER . 0.2 OUTLIER -120.04 -58.3 1.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.801 179.976 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 56' ' ' GLU . 1.8 m 156.73 -22.09 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.079 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.48 ' O ' ' CB ' ' A' ' 59' ' ' CYS . 18.0 p 48.41 178.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.79 -179.793 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.523 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 2.2 p 162.26 141.92 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.176 179.823 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.582 ' HA ' ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -124.42 89.93 3.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.257 -179.748 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.59 HG11 ' NE2' ' A' ' 90' ' ' HIS . 2.2 m -77.29 64.0 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.83 179.715 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.66 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . 26.11 106.88 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.749 0 CA-C-O 121.993 0.902 . . . . 0.0 112.471 -179.969 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.883 ' HG3' ' CB ' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -49.46 -47.14 48.57 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 113.724 -1.58 . . . . 0.0 107.708 177.023 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.642 ' OG ' ' HB3' ' A' ' 81' ' ' ALA . 2.1 p -128.52 156.19 43.67 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 113.193 -1.822 . . . . 0.0 109.243 179.304 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.704 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -141.31 160.81 39.34 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.59 0.709 . . . . 0.0 112.424 -178.308 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.785 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -127.87 28.32 5.6 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-O 122.703 1.239 . . . . 0.0 107.684 177.378 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.524 ' HD3' ' HB3' ' A' ' 75' ' ' LYS . 0.9 OUTLIER -9.23 126.27 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 112.115 -2.311 . . . . 0.0 112.033 -179.688 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.993 HG21 HG13 ' A' ' 25' ' ' ILE . 3.1 m -129.55 43.03 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.212 179.466 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.577 ' C ' ' O ' ' A' ' 68' ' ' VAL . 53.9 m -16.16 118.95 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.136 -179.303 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.831 HG21 ' CG ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -125.75 -169.23 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.856 -179.574 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.607 ' SD ' ' CE2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER 41.91 -135.57 0.3 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.977 -1.011 . . . . 0.0 110.862 -179.704 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -78.94 21.14 4.13 Favored Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.667 179.935 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 114.88 41.09 0.86 Allowed Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.296 -179.982 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.562 ' CD1' ' HB2' ' A' ' 71' ' ' MET . 3.2 m-85 -70.21 -175.73 1.03 Allowed 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 179.894 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.585 ' N ' ' CD ' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -160.15 94.39 1.1 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -179.552 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.167 HG21 ' CG2' ' A' ' 25' ' ' ILE . 31.4 m -88.98 11.8 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.491 -1.309 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.014 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.758 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER 27.14 42.35 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 105.336 -2.098 . . . . 0.0 105.336 -176.81 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.914 ' HB2' HG13 ' A' ' 68' ' ' VAL . 57.4 t30 -1.69 67.21 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.828 0 CA-C-N 113.302 -1.772 . . . . 0.0 108.597 -174.414 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 1.016 ' N ' HD12 ' A' ' 26' ' ' LEU . 37.6 m170 -34.27 122.33 0.49 Allowed 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 112.747 -2.024 . . . . 0.0 114.094 -176.493 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.554 ' OG1' ' CB ' ' A' ' 64' ' ' SER . 6.5 p -107.68 -34.25 7.05 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 113.483 -1.69 . . . . 0.0 109.513 178.362 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.883 ' CB ' ' HG3' ' A' ' 63' ' ' LYS . . . -143.17 143.41 31.78 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.808 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.578 ' CA ' ' HG2' ' A' ' 63' ' ' LYS . 1.2 m -129.6 129.86 44.92 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.943 -179.318 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.818 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 0.3 OUTLIER -120.05 105.91 11.48 Favored 'General case' 0 CA--C 1.522 -0.108 0 CA-C-O 121.07 0.462 . . . . 0.0 111.08 179.278 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.523 ' HA ' ' O ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER -81.29 143.55 32.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.595 179.83 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.405 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 4.5 p 168.76 -174.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.019 0.438 . . . . 0.0 111.277 179.991 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.423 ' O ' ' N ' ' A' ' 88' ' ' TYR . 23.9 p -48.1 126.83 11.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.855 -179.886 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.412 ' O ' ' CD1' ' A' ' 88' ' ' TYR . 1.3 m -67.82 64.45 0.08 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.704 179.758 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.462 ' O ' ' HB2' ' A' ' 89' ' ' TYR . 2.7 m-85 -155.1 142.47 19.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.025 -179.876 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.462 ' HB2' ' O ' ' A' ' 88' ' ' TYR . 3.2 m-85 66.84 75.77 0.31 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.015 179.974 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.59 ' NE2' HG11 ' A' ' 61' ' ' VAL . 7.6 m80 -72.93 -40.29 65.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.591 179.869 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.493 ' C ' ' O ' ' A' ' 90' ' ' HIS . 4.0 mmtt 27.28 70.61 0.05 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.233 -179.993 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.0 p . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.253 -0.88 . . . . 0.0 111.01 -179.994 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 1.023 ' H83' ' HB1' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.517 ' N2 ' ' H61' ' A' ' 178' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.513 ' H5 ' ' O5 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . 0.513 ' O5 ' ' H5 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.853 0.359 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -87.16 -42.63 0.05 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 123.111 2.541 . . . . 0.0 112.759 -179.738 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -119.97 42.39 2.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.194 -179.632 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.1 m -148.34 174.26 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.941 179.831 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.444 ' HA ' ' OE1' ' A' ' 5' ' ' GLN . 2.4 mm-40 -161.23 47.77 0.21 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.099 -179.943 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.595 ' O ' ' C ' ' A' ' 7' ' ' CYS . 1.9 t70 77.5 -170.05 0.06 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.047 179.859 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.595 ' C ' ' O ' ' A' ' 6' ' ' ASP . 8.8 p -2.65 113.8 0.01 OUTLIER Pre-proline 0 N--CA 1.464 0.234 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.813 -179.788 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.423 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 49.2 Cg_exo -56.11 80.11 0.03 OUTLIER 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.954 2.436 . . . . 0.0 112.365 179.958 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.557 ' O ' ' HB2' ' A' ' 10' ' ' CYS . 0.0 OUTLIER 167.72 -178.69 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.886 -179.896 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.629 ' H ' ' HA3' ' A' ' 30' ' ' GLY . 0.0 OUTLIER 83.73 94.17 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.535 -179.71 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.881 ' O ' HD12 ' A' ' 12' ' ' LEU . 1.2 t -158.53 -125.43 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.148 -179.837 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.895 HD23 HD13 ' A' ' 26' ' ' LEU . 11.1 mp -133.55 129.95 37.77 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.001 0.429 . . . . 0.0 110.919 179.644 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.655 ' O ' ' O ' ' A' ' 14' ' ' GLU . 28.1 mt-30 -106.64 55.51 0.66 Allowed 'General case' 0 CA--C 1.504 -0.824 0 CA-C-O 121.444 0.64 . . . . 0.0 111.717 -179.083 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.655 ' O ' ' O ' ' A' ' 13' ' ' GLN . 26.1 tt0 0.03 122.66 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 113.872 -1.513 . . . . 0.0 111.279 -179.611 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.936 ' ND2' HG11 ' A' ' 76' ' ' VAL . 1.0 OUTLIER -51.44 104.34 0.42 Allowed Pre-proline 0 C--N 1.303 -1.422 0 CA-C-N 113.916 -1.493 . . . . 0.0 112.826 -179.116 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.695 ' HD2' ' CE1' ' A' ' 17' ' ' PHE . 55.3 Cg_endo -69.27 7.7 0.81 Allowed 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.161 1.908 . . . . 0.0 112.121 178.943 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.697 ' CZ ' ' OD1' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -112.42 -58.95 2.07 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.22 178.778 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.867 ' CD2' HG13 ' A' ' 70' ' ' VAL . 0.4 OUTLIER -71.34 -17.03 62.46 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.556 -178.929 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.575 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -51.13 84.07 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.965 -179.606 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.57 ' O ' ' N ' ' A' ' 22' ' ' GLY . 11.4 mm100 -118.51 159.93 41.91 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.06 -179.855 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.474 ' HD2' ' HB3' ' A' ' 20' ' ' GLN . 12.9 Cg_endo -55.3 72.84 0.03 OUTLIER 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.868 2.379 . . . . 0.0 111.515 179.298 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.57 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 142.92 -13.35 2.39 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.961 -0.637 . . . . 0.0 111.903 -179.344 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.486 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -150.55 102.22 3.09 Favored Pre-proline 0 CA--C 1.511 -0.525 0 CA-C-O 122.023 0.916 . . . . 0.0 111.826 -179.79 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.665 ' O ' ' O ' ' A' ' 25' ' ' ILE . 87.3 Cg_endo -104.18 60.47 0.02 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.543 0 C-N-CA 124.873 3.715 . . . . 0.0 112.433 -179.112 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.168 ' CG2' HG21 ' A' ' 76' ' ' VAL . 19.9 mm -38.63 -175.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-N 114.916 -1.038 . . . . 0.0 113.544 -179.839 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.071 HD23 ' O ' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.13 -160.85 1.2 Allowed 'General case' 0 CA--C 1.503 -0.862 0 CA-C-O 122.398 1.094 . . . . 0.0 113.699 -174.99 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.571 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 16.6 tt0 163.63 66.2 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 113.179 -1.828 . . . . 0.0 111.261 179.298 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.683 ' HA ' ' O ' ' A' ' 11' ' ' THR . 38.9 t -18.96 115.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.573 179.874 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.511 ' HB2' ' HG3' ' A' ' 13' ' ' GLN . 0.6 OUTLIER -140.36 92.35 2.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.354 179.629 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.629 ' HA3' ' H ' ' A' ' 10' ' ' CYS . . . -156.7 -144.96 4.07 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.904 -179.384 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.559 ' O ' ' HB2' ' A' ' 32' ' ' CYS . 11.8 t -30.35 152.79 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.875 0.369 . . . . 0.0 111.178 -179.948 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.559 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 61.3 m 79.54 10.97 1.36 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.599 -179.766 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.625 ' CE2' ' HA2' ' A' ' 30' ' ' GLY . 0.0 OUTLIER -99.39 15.59 25.82 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.872 179.61 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.504 ' O ' ' N ' ' A' ' 36' ' ' ALA . 2.3 p -131.55 -35.08 1.32 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.855 179.813 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.468 ' C ' ' O ' ' A' ' 34' ' ' SER . 0.1 OUTLIER -30.08 91.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.267 -179.912 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.559 ' O ' ' C ' ' A' ' 37' ' ' TYR . . . 176.58 34.34 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.159 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.559 ' C ' ' O ' ' A' ' 36' ' ' ALA . 58.9 m-85 -17.65 133.17 0.03 OUTLIER Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.606 179.954 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.471 ' O ' ' O ' ' A' ' 37' ' ' TYR . 73.9 Cg_exo -51.09 -165.93 0.0 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.584 2.189 . . . . 0.0 111.636 179.44 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.525 ' OG1' ' CB ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER 175.19 176.51 0.22 Allowed Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 121.019 0.438 . . . . 0.0 111.24 179.811 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.472 ' CD ' HG22 ' A' ' 39' ' ' THR . 73.8 Cg_endo -84.91 -68.23 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.924 2.416 . . . . 0.0 112.928 -179.691 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.9 mt -83.93 -7.19 59.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.351 -179.57 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.525 ' CB ' ' OG1' ' A' ' 39' ' ' THR . 0.0 OUTLIER -71.58 130.27 40.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.897 -179.992 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.461 ' HB2' ' OG1' ' A' ' 46' ' ' THR . 0.2 OUTLIER -127.6 -178.51 4.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.134 -179.963 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.5 mttt -60.57 -82.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.937 -179.92 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.29 -7.08 8.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.043 -179.894 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.461 ' OG1' ' HB2' ' A' ' 43' ' ' SER . 0.0 OUTLIER -57.68 134.58 56.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.826 -179.953 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.698 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER 68.0 9.12 6.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.601 -179.634 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.698 HD12 ' O ' ' A' ' 47' ' ' MET . 0.0 OUTLIER 45.49 -173.25 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.285 179.728 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.439 ' O ' ' O ' ' A' ' 50' ' ' GLN . 2.4 m -143.58 164.25 15.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.906 -179.942 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.439 ' O ' ' O ' ' A' ' 49' ' ' VAL . 1.9 mm-40 -36.57 157.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.785 179.868 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.35 164.93 12.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.917 179.918 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.505 ' O ' ' O ' ' A' ' 53' ' ' VAL . 10.5 t-20 61.67 81.93 0.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.102 -179.964 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.505 ' O ' ' O ' ' A' ' 52' ' ' ASN . 18.7 m 35.52 -162.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.429 179.856 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.51 ' O ' ' O ' ' A' ' 55' ' ' SER . 0.2 OUTLIER -176.3 87.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.999 -179.838 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.51 ' O ' ' O ' ' A' ' 54' ' ' THR . 0.1 OUTLIER 35.1 99.36 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.077 179.921 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -117.28 155.75 28.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.172 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.472 ' O ' ' HA ' ' A' ' 85' ' ' SER . 0.0 OUTLIER -134.12 -41.89 0.81 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.64 179.742 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.561 HG22 ' HB2' ' A' ' 85' ' ' SER . 0.6 OUTLIER -95.53 167.03 11.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.687 179.649 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.594 ' C ' ' HA ' ' A' ' 84' ' ' CYS . 1.8 p 168.65 103.5 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.089 0.471 . . . . 0.0 112.179 179.686 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.616 ' O ' ' SG ' ' A' ' 82' ' ' CYS . 0.8 OUTLIER -88.96 47.99 1.57 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.444 178.894 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.65 ' O ' ' O ' ' A' ' 62' ' ' ALA . 31.0 m -76.22 65.66 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.241 179.312 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.65 ' O ' ' O ' ' A' ' 61' ' ' VAL . . . 24.06 107.93 0.0 OUTLIER 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.976 -178.621 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.923 ' HB2' ' CD2' ' A' ' 83' ' ' HIS . 1.2 ttmt -51.38 -36.24 42.43 Favored 'General case' 0 CA--C 1.503 -0.855 0 CA-C-O 121.797 0.808 . . . . 0.0 109.452 179.614 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.591 ' OG ' ' HB3' ' A' ' 81' ' ' ALA . 2.0 p -143.84 142.16 30.7 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.193 -1.367 . . . . 0.0 109.044 178.864 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.672 ' CG ' ' CG ' ' A' ' 77' ' ' GLU . 1.1 p90 -129.54 165.92 20.72 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.672 0.749 . . . . 0.0 112.601 -178.775 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.789 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -133.96 27.48 3.9 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 114.401 -1.272 . . . . 0.0 107.76 176.688 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.674 ' HB3' ' HA ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -6.86 121.91 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 112.077 -2.329 . . . . 0.0 112.053 179.911 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 1.055 HG21 ' CD1' ' A' ' 25' ' ' ILE . 3.8 m -129.16 44.12 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.055 179.516 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.71 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 36.6 m -18.09 118.0 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.68 -178.799 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.867 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -110.92 -163.42 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.772 0.796 . . . . 0.0 111.812 179.538 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.644 ' HG3' ' CD2' ' A' ' 74' ' ' PHE . 2.4 ptm -34.14 145.57 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.393 -1.276 . . . . 0.0 111.519 -179.555 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 54.3 10.56 2.01 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.659 -0.782 . . . . 0.0 111.977 -179.532 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.501 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 80.68 33.84 29.62 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.192 -179.854 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.71 ' O ' ' HA ' ' A' ' 69' ' ' THR . 9.6 m-85 -65.44 110.29 2.62 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.988 0.423 . . . . 0.0 111.016 -179.873 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.498 ' CD ' ' OG1' ' A' ' 69' ' ' THR . 9.6 mmmt -94.1 98.48 11.02 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.525 -179.837 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.168 HG21 ' CG2' ' A' ' 25' ' ' ILE . 30.1 m -87.53 10.98 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.489 -1.381 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.136 179.149 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.783 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER 27.45 41.43 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 -177.396 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 1.01 ' HB2' HG13 ' A' ' 68' ' ' VAL . 45.0 t30 -0.67 64.95 0.0 OUTLIER 'General case' 0 CA--C 1.501 -0.916 0 CA-C-N 113.371 -1.741 . . . . 0.0 108.542 -174.48 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 1.001 ' N ' HD12 ' A' ' 26' ' ' LEU . 36.9 m170 -37.12 122.05 0.84 Allowed 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 112.75 -2.023 . . . . 0.0 113.746 -176.503 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.573 ' OG1' ' HB2' ' A' ' 64' ' ' SER . 2.6 p -108.29 -8.86 15.59 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 113.504 -1.68 . . . . 0.0 109.622 178.718 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.795 ' O ' ' N ' ' A' ' 63' ' ' LYS . . . -173.99 137.52 0.57 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.81 179.001 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.776 ' C ' ' CD2' ' A' ' 83' ' ' HIS . 1.8 t -127.7 131.26 49.79 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.7 0.286 . . . . 0.0 111.164 179.855 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.923 ' CD2' ' HB2' ' A' ' 63' ' ' LYS . 3.9 m-70 -142.91 116.95 9.43 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.642 -179.821 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.632 ' O ' ' CB ' ' A' ' 85' ' ' SER . 0.0 OUTLIER -91.95 117.81 30.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.49 179.627 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.632 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 6.9 t 98.04 54.74 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.617 -179.532 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.489 ' O ' ' OG1' ' A' ' 86' ' ' THR . 0.1 OUTLIER -156.97 35.73 0.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.362 -179.849 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 93.3 m -96.11 -168.8 1.81 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.27 -179.644 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.443 ' O ' ' HB3' ' A' ' 89' ' ' TYR . 1.2 t80 -91.05 -153.37 0.31 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.34 -179.645 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.525 ' O ' ' CB ' ' A' ' 90' ' ' HIS . 80.0 t80 67.06 132.21 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.224 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.525 ' CB ' ' O ' ' A' ' 89' ' ' TYR . 0.7 OUTLIER 85.19 116.83 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.051 179.664 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.461 ' O ' ' C ' ' A' ' 92' ' ' SER . 0.1 OUTLIER -173.81 141.02 0.79 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.042 179.865 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.461 ' C ' ' O ' ' A' ' 91' ' ' LYS . 15.1 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.986 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 0.709 ' H82' HD11 ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.636 ' H3 ' ' O7 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . 0.474 ' H61' ' H2 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . 0.474 ' H2 ' ' H61' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . 0.591 ' H4 ' ' O2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.776 ' H3 ' ' O2 ' ' A' ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . 0.776 ' O2 ' ' H3 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . 0.591 ' O2 ' ' H4 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.964 ' HB3' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.713 0.292 . . . . 0.0 111.301 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.964 ' HD3' ' HB3' ' A' ' 1' ' ' ALA . 76.8 Cg_exo -38.75 -31.5 0.24 Allowed 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.939 2.426 . . . . 0.0 112.849 -179.768 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.445 ' OD2' ' HG3' ' A' ' 8' ' ' PRO . 0.3 OUTLIER -114.29 90.02 3.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.843 0.354 . . . . 0.0 111.249 -179.572 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.7 t -50.21 116.78 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.571 179.647 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 64.33 166.99 0.16 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.327 -179.681 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 73.17 135.22 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.334 -179.586 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.622 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 0.5 OUTLIER -107.22 103.97 50.39 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.242 0.544 . . . . 0.0 111.664 -179.479 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.534 ' HD2' ' HE3' ' A' ' 29' ' ' MET . 5.7 Cg_endo -86.06 161.62 10.17 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.349 2.7 . . . . 0.0 111.857 179.91 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.481 ' C ' ' O ' ' A' ' 8' ' ' PRO . 0.6 OUTLIER -28.06 140.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.96 0.409 . . . . 0.0 110.942 179.928 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.474 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 44.3 t -33.27 114.86 0.19 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.073 -179.815 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.616 ' OG1' ' N ' ' A' ' 12' ' ' LEU . 0.8 OUTLIER -136.56 -142.04 0.17 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.667 179.844 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.876 HD23 HD13 ' A' ' 26' ' ' LEU . 1.5 mp -114.94 140.88 48.65 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.714 0.293 . . . . 0.0 110.368 179.633 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.761 ' HG3' ' HA ' ' A' ' 29' ' ' MET . 3.1 mm-40 -101.2 50.08 0.87 Allowed 'General case' 0 CA--C 1.499 -0.991 0 CA-C-O 121.936 0.874 . . . . 0.0 111.204 -179.41 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.651 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 2.2 tt0 -0.25 120.12 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 113.183 -1.826 . . . . 0.0 111.554 -179.4 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.972 ' ND2' HG11 ' A' ' 76' ' ' VAL . 1.1 t-20 -52.55 120.29 17.82 Favored Pre-proline 0 C--N 1.308 -1.204 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.56 -179.815 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -82.34 16.93 1.67 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.479 2.119 . . . . 0.0 112.094 179.592 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.629 ' CE2' ' HG3' ' A' ' 71' ' ' MET . 86.9 t80 -123.73 -54.69 1.74 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.874 -179.921 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.957 ' CD1' HG12 ' A' ' 70' ' ' VAL . 0.3 OUTLIER -75.09 -7.47 53.83 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.318 -179.353 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.625 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -60.0 101.58 0.13 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.651 -179.308 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.593 ' CB ' ' HD2' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -115.41 177.45 1.19 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.265 179.334 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.593 ' HD2' ' CB ' ' A' ' 20' ' ' GLN . 59.5 Cg_endo -71.44 60.38 2.64 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.484 2.122 . . . . 0.0 111.748 179.566 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 149.65 -10.06 0.92 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.499 -179.576 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 1.005 ' HB1' ' H83' ' A' ' 178' ' ' NAG . . . -146.95 99.4 4.0 Favored Pre-proline 0 CA--C 1.509 -0.625 0 CA-C-O 122.15 0.976 . . . . 0.0 112.021 -179.657 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.708 ' HD2' ' H3 ' ' A' ' 178' ' ' NAG . 98.0 Cg_endo -104.8 79.94 0.02 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.707 0 C-N-CA 125.094 3.863 . . . . 0.0 112.687 -179.054 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.233 ' CG2' HG21 ' A' ' 76' ' ' VAL . 24.3 mm -42.56 -173.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-N 115.509 -0.769 . . . . 0.0 113.019 -179.939 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.005 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -152.97 -159.18 0.97 Allowed 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 -174.822 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.671 ' O ' ' O ' ' A' ' 28' ' ' CYS . 4.0 tm0? 166.04 56.96 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 112.603 -2.09 . . . . 0.0 111.143 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.671 ' O ' ' O ' ' A' ' 27' ' ' GLN . 0.8 OUTLIER 18.37 119.16 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.918 179.876 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.761 ' HA ' ' HG3' ' A' ' 13' ' ' GLN . 5.8 tmm? -73.39 -89.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.899 179.041 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.42 ' O ' ' SD ' ' A' ' 29' ' ' MET . . . 114.22 117.04 3.25 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.501 -179.961 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 178.42 58.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.841 0.353 . . . . 0.0 110.74 179.927 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.653 ' HB2' HG21 ' A' ' 58' ' ' THR . 0.0 OUTLIER -92.66 -171.67 2.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.461 179.829 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.441 ' O ' ' CB ' ' A' ' 34' ' ' SER . 0.1 OUTLIER -174.23 172.64 3.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.906 0.384 . . . . 0.0 111.019 179.996 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.441 ' CB ' ' O ' ' A' ' 33' ' ' PHE . 0.5 OUTLIER 165.07 38.75 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.869 -179.871 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.473 ' HD2' ' C ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER 40.34 96.74 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.005 -179.967 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.78 140.38 58.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.826 179.737 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.602 ' O ' ' CG ' ' A' ' 37' ' ' TYR . 14.7 t80 -142.62 43.02 0.45 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.914 179.952 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 37' ' ' TYR . 18.6 Cg_endo -59.49 -166.78 0.03 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.524 2.15 . . . . 0.0 112.046 179.759 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.43 ' HA ' ' HD3' ' A' ' 40' ' ' PRO . 1.6 t -81.78 152.89 69.86 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.763 179.883 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.434 ' O ' ' C ' ' A' ' 41' ' ' LEU . 5.5 Cg_endo -85.91 52.28 2.98 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.253 2.635 . . . . 0.0 112.165 179.934 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.434 ' C ' ' O ' ' A' ' 40' ' ' PRO . 1.9 mp 35.19 -152.91 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.705 -179.786 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.52 -30.08 8.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.787 179.918 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.402 ' CB ' ' HE3' ' A' ' 45' ' ' LYS . 1.1 m 173.54 -35.11 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.861 179.931 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.2 tptm 66.76 14.5 9.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.63 -179.796 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.501 ' O ' ' HB ' ' A' ' 46' ' ' THR . 9.6 pttp -79.49 105.63 10.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.948 -179.969 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.524 HG23 ' N ' ' A' ' 47' ' ' MET . 0.4 OUTLIER 167.7 169.93 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.59 -179.965 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.524 ' N ' HG23 ' A' ' 46' ' ' THR . 0.0 OUTLIER -51.33 -177.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.726 179.866 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.752 ' C ' HD12 ' A' ' 48' ' ' LEU . 2.9 pp -139.63 165.71 26.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.922 179.972 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.496 ' O ' ' O ' ' A' ' 50' ' ' GLN . 1.2 p -165.82 127.24 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.024 179.699 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.496 ' O ' ' O ' ' A' ' 49' ' ' VAL . 0.3 OUTLIER 49.11 109.64 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.121 179.803 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.404 ' O ' ' HG2' ' A' ' 50' ' ' GLN . 1.7 mttt -55.87 176.13 0.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.258 179.454 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -135.21 153.39 51.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.113 0.483 . . . . 0.0 111.258 -179.897 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -137.61 90.67 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.808 179.597 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -158.49 122.73 4.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.796 -179.986 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.569 ' O ' ' C ' ' A' ' 56' ' ' GLU . 4.6 m -129.3 90.57 3.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.176 -179.771 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.569 ' C ' ' O ' ' A' ' 55' ' ' SER . 0.0 OUTLIER 12.46 104.93 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.849 179.753 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.42 ' O ' ' C ' ' A' ' 58' ' ' THR . 3.2 m -116.66 49.55 1.15 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.003 179.899 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.653 HG21 ' HB2' ' A' ' 32' ' ' CYS . 40.6 p 37.12 -145.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.786 179.871 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.68 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 0.8 OUTLIER -151.36 97.8 2.45 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.057 0.456 . . . . 0.0 112.125 -179.83 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.56 ' C ' HG12 ' A' ' 61' ' ' VAL . 59.2 m -89.36 165.57 14.29 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.39 179.13 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.839 HG22 ' O ' ' A' ' 61' ' ' VAL . 1.3 p 162.68 66.18 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.298 -179.697 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.745 ' HB1' ' O ' ' A' ' 64' ' ' SER . . . 3.03 103.32 0.01 OUTLIER 'General case' 0 CA--C 1.504 -0.793 0 CA-C-O 121.913 0.863 . . . . 0.0 112.559 -179.294 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.81 ' HG3' ' C ' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -48.36 -44.19 34.24 Favored 'General case' 0 CA--C 1.49 -1.327 0 CA-C-N 113.845 -1.525 . . . . 0.0 107.134 177.014 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.749 ' HB3' ' OG1' ' A' ' 80' ' ' THR . 14.2 t -125.54 -178.61 4.3 Favored 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 112.849 -1.978 . . . . 0.0 109.407 179.647 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.625 ' CB ' ' CG ' ' A' ' 77' ' ' GLU . 3.0 p90 -162.27 160.51 26.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.281 0.562 . . . . 0.0 111.703 -179.491 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.943 ' HB3' ' HB3' ' A' ' 78' ' ' ASN . 43.9 t-20 -133.92 28.93 3.82 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 122.851 1.31 . . . . 0.0 107.696 177.501 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.55 ' O ' ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -6.14 130.3 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 111.616 -2.538 . . . . 0.0 112.551 -179.856 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 1.015 HG21 ' CG1' ' A' ' 25' ' ' ILE . 3.5 m -139.78 47.8 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.311 179.696 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.624 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 90.1 m -15.89 118.13 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.285 -179.016 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.957 HG12 ' CD1' ' A' ' 18' ' ' PHE . 3.0 m -120.28 -160.46 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.8 0 CA-C-O 121.726 0.774 . . . . 0.0 111.913 -179.867 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.629 ' HG3' ' CE2' ' A' ' 17' ' ' PHE . 29.0 mtp -13.04 131.61 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 113.874 -1.512 . . . . 0.0 112.854 -178.955 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 40.03 24.78 0.06 OUTLIER Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 115.458 -0.792 . . . . 0.0 113.214 179.059 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.536 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 84.91 36.98 10.58 Favored Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.872 179.724 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.725 ' HB2' ' CG2' ' A' ' 70' ' ' VAL . 1.2 m-30 -74.59 122.14 22.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.931 0.395 . . . . 0.0 110.822 179.923 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.18 109.62 22.28 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.784 -179.483 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.233 HG21 ' CG2' ' A' ' 25' ' ' ILE . 34.8 m -98.87 11.76 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.229 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.53 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.705 ' O ' ' N ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER 25.27 42.32 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 -176.968 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.943 ' HB3' ' HB3' ' A' ' 66' ' ' ASN . 51.6 t30 -1.3 67.75 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 113.185 -1.825 . . . . 0.0 109.083 -174.466 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 1.005 ' N ' HD12 ' A' ' 26' ' ' LEU . 39.1 m170 -37.36 121.09 0.82 Allowed 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 112.928 -1.942 . . . . 0.0 113.781 -176.921 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.749 ' OG1' ' HB3' ' A' ' 64' ' ' SER . 2.2 p -104.47 -32.2 9.11 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 113.448 -1.706 . . . . 0.0 109.21 178.203 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.81 ' C ' ' HG3' ' A' ' 63' ' ' LYS . . . -143.15 136.06 27.83 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 177.795 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 62' ' ' ALA . 1.2 m -124.25 134.74 53.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.902 0.382 . . . . 0.0 110.852 179.973 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.822 ' NE2' HG13 ' A' ' 61' ' ' VAL . 2.0 p80 -119.62 107.39 13.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.384 -179.468 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.68 ' HA ' ' O ' ' A' ' 59' ' ' CYS . 0.5 OUTLIER -108.44 117.55 34.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.309 179.391 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' A' ' 84' ' ' CYS . 3.0 p 92.56 175.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.741 -179.638 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 46.73 23.97 0.29 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.929 179.971 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.508 ' O ' ' C ' ' A' ' 88' ' ' TYR . 2.3 p -72.04 105.32 3.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.718 179.95 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.508 ' C ' ' O ' ' A' ' 87' ' ' CYS . 5.1 m-30 -25.18 115.7 0.05 Allowed 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.221 -179.765 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.43 -175.23 4.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.833 -179.599 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.445 ' O ' ' C ' ' A' ' 91' ' ' LYS . 0.2 OUTLIER -163.54 25.52 0.08 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.696 179.797 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.445 ' C ' ' O ' ' A' ' 90' ' ' HIS . 8.0 mmtp 34.22 38.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.74 -179.857 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 90' ' ' HIS . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.189 -0.91 . . . . 0.0 110.923 -179.892 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 1.005 ' H83' ' HB1' ' A' ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . 0.569 ' H3 ' ' O7 ' ' A' ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . 0.448 ' H5 ' ' H5 ' ' A' ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . 0.526 ' O2 ' ' O7 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . 0.448 ' H5 ' ' H5 ' ' A' ' 180' ' ' BMA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . 0.758 ' H4 ' ' O2 ' ' A' ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . 0.755 ' O7 ' ' C1 ' ' A' ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . 0.758 ' O2 ' ' H4 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.423 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.715 0.293 . . . . 0.0 110.876 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 1' ' ' ALA . 2.6 Cg_exo -75.28 108.55 2.73 Favored 'Trans proline' 0 N--CA 1.463 -0.277 0 C-N-CA 122.943 2.429 . . . . 0.0 112.417 -179.708 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.507 ' O ' ' N ' ' A' ' 5' ' ' GLN . 0.2 OUTLIER -146.83 26.89 1.1 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.978 179.869 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 4' ' ' VAL . 7.6 m 33.45 33.5 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.083 179.927 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.507 ' N ' ' O ' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -94.2 -166.49 1.5 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.98 179.982 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.464 ' OD1' ' NE2' ' A' ' 5' ' ' GLN . 0.0 OUTLIER -58.81 109.92 0.91 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.925 -179.981 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.436 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 35.4 t -35.44 123.22 0.63 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.023 179.982 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.517 ' O ' ' CZ ' ' A' ' 33' ' ' PHE . 42.9 Cg_exo -57.13 -155.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 122.963 2.442 . . . . 0.0 112.494 -179.92 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.493 ' O ' ' C ' ' A' ' 10' ' ' CYS . 3.0 tt0 -124.1 139.61 53.77 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.144 -179.881 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.547 ' HA ' ' C ' ' A' ' 30' ' ' GLY . 49.0 t -27.32 120.41 0.1 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.389 179.818 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.713 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 9.2 t -170.14 -176.05 2.15 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-O 121.185 0.517 . . . . 0.0 110.821 179.582 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.929 HD23 HD13 ' A' ' 26' ' ' LEU . 2.4 mp -95.41 138.12 33.54 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.668 179.354 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.73 ' O ' ' O ' ' A' ' 14' ' ' GLU . 3.7 pt20 -123.0 69.23 0.99 Allowed 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 122.134 0.969 . . . . 0.0 111.749 178.831 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.73 ' O ' ' O ' ' A' ' 13' ' ' GLN . 28.0 tt0 14.78 123.57 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 112.704 -2.044 . . . . 0.0 112.255 179.998 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.934 HD22 HG11 ' A' ' 76' ' ' VAL . 33.2 t-20 -48.05 107.26 0.71 Allowed Pre-proline 0 C--N 1.306 -1.31 0 CA-C-N 113.527 -1.67 . . . . 0.0 112.072 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.732 ' HD2' ' CE1' ' A' ' 17' ' ' PHE . 72.8 Cg_endo -73.81 16.37 0.52 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.407 2.072 . . . . 0.0 112.958 179.7 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.732 ' CE1' ' HD2' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -126.24 -57.54 1.39 Allowed 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 121.787 0.804 . . . . 0.0 110.205 178.832 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.966 ' CD2' HG13 ' A' ' 70' ' ' VAL . 2.7 t80 -71.92 -19.19 61.96 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.219 -179.088 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.597 ' HB3' ' O ' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -48.76 87.61 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.546 -179.983 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.559 ' O ' ' N ' ' A' ' 22' ' ' GLY . 10.2 mm-40 -112.3 166.3 11.25 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.941 -179.65 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -61.85 60.83 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.752 2.301 . . . . 0.0 111.329 179.337 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.559 ' N ' ' O ' ' A' ' 20' ' ' GLN . . . 155.45 -14.24 0.45 Allowed Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.635 -179.611 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.452 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . . . -142.97 108.87 5.44 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-O 121.784 0.802 . . . . 0.0 111.678 -179.492 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.634 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.8 Cg_endo -103.97 60.39 0.02 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.428 0 C-N-CA 124.613 3.542 . . . . 0.0 113.199 -178.556 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.31 ' CG2' HG21 ' A' ' 76' ' ' VAL . 31.6 mm -43.48 -174.07 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 CA-C-N 115.327 -0.852 . . . . 0.0 112.566 179.194 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.941 HD12 ' N ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -145.23 -168.27 2.9 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -175.011 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 172.4 96.01 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 111.482 -2.599 . . . . 0.0 109.99 179.2 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.713 ' HA ' ' O ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -40.51 112.49 0.29 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.83 -178.924 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.549 ' HB2' ' HG2' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -121.26 -19.01 7.21 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.463 -0.495 . . . . 0.0 111.946 -179.874 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.547 ' C ' ' HA ' ' A' ' 10' ' ' CYS . . . -44.59 179.99 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.342 -0.932 . . . . 0.0 112.377 179.978 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.502 ' SG ' ' O ' ' A' ' 31' ' ' CYS . 15.4 p -144.75 104.05 3.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.953 0.406 . . . . 0.0 110.756 179.619 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.427 ' HB3' ' HB2' ' A' ' 10' ' ' CYS . 0.5 OUTLIER -79.84 135.27 36.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.135 -179.62 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.517 ' CZ ' ' O ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -135.04 130.33 35.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.729 179.886 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.0 p -42.89 153.05 0.09 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.132 -179.939 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.515 ' O ' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -95.9 166.37 11.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.252 -179.84 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.515 ' HB3' ' O ' ' A' ' 35' ' ' ARG . . . 73.39 138.66 0.06 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.453 179.821 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -63.25 156.21 70.26 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.799 179.904 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.702 ' O ' HG23 ' A' ' 39' ' ' THR . 63.1 Cg_endo -73.96 114.29 4.0 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.608 2.205 . . . . 0.0 112.361 -179.964 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.702 HG23 ' O ' ' A' ' 38' ' ' PRO . 1.1 p -167.43 164.35 9.38 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.982 -179.941 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -80.29 -166.15 0.39 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.152 2.568 . . . . 0.0 112.091 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.504 ' HG ' ' N ' ' A' ' 42' ' ' ARG . 0.2 OUTLIER 177.72 -35.83 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.69 179.888 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.656 ' O ' ' CB ' ' A' ' 43' ' ' SER . 0.0 OUTLIER 82.01 79.31 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.062 179.795 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.656 ' CB ' ' O ' ' A' ' 42' ' ' ARG . 8.9 t 142.17 5.53 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.049 179.73 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.47 ' C ' ' O ' ' A' ' 43' ' ' SER . 2.1 tttp -31.1 130.69 0.11 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.821 0.343 . . . . 0.0 111.169 -179.998 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.521 ' O ' ' C ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -54.62 114.88 1.86 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.494 179.767 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.521 ' C ' ' O ' ' A' ' 45' ' ' LYS . 5.4 t -26.25 91.44 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.991 -179.804 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.577 ' C ' HD13 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -73.85 150.45 40.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.159 -179.58 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.893 HD13 ' N ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -145.53 159.08 43.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.884 -179.918 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.588 HG11 ' HB3' ' A' ' 55' ' ' SER . 0.0 OUTLIER -127.58 172.27 14.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.062 -179.945 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -42.55 138.77 1.73 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.529 179.943 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.598 ' HE3' ' CD2' ' A' ' 88' ' ' TYR . 32.9 mttp 46.18 -139.64 0.49 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.27 -179.811 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -132.67 19.55 4.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.053 0.454 . . . . 0.0 110.416 179.359 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.408 ' O ' ' O ' ' A' ' 54' ' ' THR . 33.5 m -149.24 162.25 4.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.889 179.906 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.453 HG22 ' O ' ' A' ' 54' ' ' THR . 2.6 m 44.55 96.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.953 -179.851 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.588 ' HB3' HG11 ' A' ' 49' ' ' VAL . 1.7 m -93.32 152.8 18.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.977 -179.984 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.429 ' O ' ' CB ' ' A' ' 57' ' ' SER . 13.1 mt-10 -143.28 -79.34 0.21 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.876 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.429 ' CB ' ' O ' ' A' ' 56' ' ' GLU . 4.1 p 164.75 -178.65 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.613 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.586 HG22 ' HA ' ' A' ' 85' ' ' SER . 1.3 p -42.47 155.47 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.774 -179.914 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.493 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 18.8 p -148.8 129.51 14.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.136 0.493 . . . . 0.0 111.539 -179.737 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.864 ' O ' HG23 ' A' ' 61' ' ' VAL . 71.0 m -85.86 -169.87 2.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.145 179.77 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.864 HG23 ' O ' ' A' ' 60' ' ' CYS . 2.6 t 142.59 79.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.377 179.822 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.702 ' HB2' ' CG ' ' A' ' 79' ' ' HIS . . . -6.11 105.75 0.01 OUTLIER 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 122.065 0.936 . . . . 0.0 112.415 -179.916 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.792 ' HG3' ' CB ' ' A' ' 81' ' ' ALA . 0.1 OUTLIER -50.51 -43.53 55.77 Favored 'General case' 0 CA--C 1.495 -1.142 0 CA-C-N 113.733 -1.576 . . . . 0.0 108.397 177.802 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.607 ' CB ' ' OG1' ' A' ' 80' ' ' THR . 43.7 m -133.11 135.51 45.29 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 113.637 -1.619 . . . . 0.0 109.48 179.906 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.817 ' HB3' ' HB2' ' A' ' 77' ' ' GLU . 0.1 OUTLIER -125.71 163.02 23.73 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.604 0.716 . . . . 0.0 112.436 -177.88 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.794 ' CB ' ' HB3' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -132.12 30.18 4.27 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 122.704 1.24 . . . . 0.0 107.9 177.388 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.54 ' CG ' ' HA ' ' A' ' 77' ' ' GLU . 0.2 OUTLIER -8.69 128.15 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 112.075 -2.329 . . . . 0.0 112.148 -179.786 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 1.047 HG21 HG13 ' A' ' 25' ' ' ILE . 4.6 m -134.84 49.52 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.454 179.915 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.661 ' HA ' ' O ' ' A' ' 74' ' ' PHE . 55.2 m -23.2 118.62 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.196 -179.173 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.966 HG13 ' CD2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -111.65 -167.39 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.726 0.774 . . . . 0.0 112.366 -179.603 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.521 ' C ' ' O ' ' A' ' 70' ' ' VAL . 1.2 mmm 16.62 -131.7 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.14 -1.391 . . . . 0.0 112.191 -179.937 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.81 -4.06 1.97 Allowed Glycine 0 N--CA 1.445 -0.74 0 CA-C-N 115.447 -0.797 . . . . 0.0 113.287 -179.63 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.587 ' HA2' ' CG2' ' A' ' 69' ' ' THR . . . 130.22 28.68 0.7 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.137 -179.766 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.661 ' O ' ' HA ' ' A' ' 69' ' ' THR . 23.0 m-85 -66.13 120.42 13.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.831 0.348 . . . . 0.0 110.943 -179.644 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.506 ' HB3' ' HD3' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -99.79 115.56 29.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.804 -179.391 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 1.31 HG21 ' CG2' ' A' ' 25' ' ' ILE . 19.0 m -104.16 11.14 8.51 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.273 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.989 178.967 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.817 ' HB2' ' HB3' ' A' ' 65' ' ' TYR . 0.0 OUTLIER 27.39 41.5 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 -177.172 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.915 ' HB2' HG13 ' A' ' 68' ' ' VAL . 50.3 t30 -1.23 68.09 0.0 OUTLIER 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 113.729 -1.578 . . . . 0.0 109.149 -174.566 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.941 ' N ' HD12 ' A' ' 26' ' ' LEU . 41.8 m170 -38.59 120.19 0.91 Allowed 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 112.57 -2.105 . . . . 0.0 113.905 -176.743 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.607 ' OG1' ' CB ' ' A' ' 64' ' ' SER . 2.2 p -105.14 -34.88 7.79 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 113.503 -1.681 . . . . 0.0 109.557 178.542 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.792 ' CB ' ' HG3' ' A' ' 63' ' ' LYS . . . -140.89 140.04 34.48 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 177.625 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.585 ' SG ' HD11 ' A' ' 12' ' ' LEU . 0.8 OUTLIER -128.09 133.71 49.06 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.59 -0.444 . . . . 0.0 111.818 -179.071 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.555 ' HB3' ' CD ' ' A' ' 63' ' ' LYS . 8.0 p80 -114.95 -175.39 2.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.673 179.713 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 59' ' ' CYS . 7.8 t -172.35 104.39 0.17 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.446 179.869 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.586 ' HA ' HG22 ' A' ' 58' ' ' THR . 2.7 p 162.32 164.01 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.93 -179.757 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.562 ' C ' ' O ' ' A' ' 85' ' ' SER . 54.6 m -15.65 113.22 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.513 -179.861 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 36.3 m -80.84 -173.21 4.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.365 -179.706 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.598 ' CD2' ' HE3' ' A' ' 51' ' ' LYS . 0.0 OUTLIER 62.96 175.64 0.15 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.009 179.876 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.478 ' O ' ' HB3' ' A' ' 90' ' ' HIS . 11.4 t80 58.69 126.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.862 179.916 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.576 ' CG ' ' O ' ' A' ' 90' ' ' HIS . 28.7 t60 66.5 59.69 0.62 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.011 0.434 . . . . 0.0 110.402 -179.673 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.9 -63.54 1.15 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.106 -179.717 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.913 -179.879 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 178' ' ' NAG . . . . . 1.07 ' H82' HD11 ' A' ' 25' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 179' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 180' ' ' BMA . . . . . 0.456 ' O4 ' ' H2 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 181' ' ' MAN . . . . . 0.487 ' O3 ' ' H5 ' ' A' ' 183' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 182' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 183' ' ' NAG . . . . . 0.487 ' H5 ' ' O3 ' ' A' ' 181' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 184' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 185' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 186' ' ' GAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_