data_1wje_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 1wje _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 9.6 m-85 . . . . . 0 N--CA 1.489 1.485 0 CA-C-O 121.594 0.711 . . . . 1.3300000000000001 109.139 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 65.5 mt -104.35 145.44 30.25 Favored 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 121.966 0.889 . . . . 1.1499999999999999 111.187 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.516 ' O ' ' N ' ' A' ' 5' ' ' ILE . 46.5 m-20 -59.96 -39.2 84.8 Favored 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 107.942 -1.132 . . . . 2.1299999999999999 107.942 178.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -46.32 -15.63 0.14 Allowed Glycine 0 N--CA 1.494 2.509 0 N-CA-C 109.224 -1.55 . . . . 0.62 109.224 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.516 ' N ' ' O ' ' A' ' 3' ' ' ASP . 83.0 mt -60.07 -39.99 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.068 -1.254 . . . . 1.0600000000000001 108.298 178.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.28 -39.65 83.61 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 107.912 -1.144 . . . . 2.0899999999999999 107.912 179.196 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.6 tttm -62.75 -40.03 95.97 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-O 121.619 0.723 . . . . 2.8199999999999998 109.477 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.53 -35.53 78.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.527 -0.733 . . . . 1.05 110.28 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -59.96 -39.98 87.47 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.948 -1.095 . . . . 1.4099999999999999 108.966 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -61.44 -39.99 92.86 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.633 -0.667 . . . . 2.3999999999999999 110.031 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -95.87 6.62 48.46 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.234 -0.916 . . . . 2.0099999999999998 110.288 -178.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 52.2 t -51.05 -41.85 60.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.977 -1.077 . . . . 0.42999999999999999 108.455 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.609 ' O ' ' ND1' ' A' ' 16' ' ' HIS . 5.5 mt-10 -60.03 -35.98 76.29 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.9 -0.778 . . . . 2.1099999999999999 108.9 179.031 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -64.93 -39.53 93.64 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.587 -0.696 . . . . 2.8599999999999999 110.275 -178.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -85.48 -12.11 52.63 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.1 -1.0 . . . . 1.1200000000000001 109.629 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.671 ' N ' ' HD1' ' A' ' 16' ' ' HIS . 0.1 OUTLIER 57.74 -134.69 1.1 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.4 -0.813 . . . . 2.25 109.929 179.234 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.68 -3.88 58.75 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.692 -0.63 . . . . 1.8600000000000001 109.634 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -80.28 76.46 7.07 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.05 -1.031 . . . . 0.81000000000000005 109.807 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 69.6 p-90 -69.98 -26.64 64.18 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.349 -0.844 . . . . 0.5 109.519 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -60.05 -40.97 91.28 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.302 -0.873 . . . . 2.1299999999999999 110.257 -179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.03 -41.97 90.23 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.144 -0.972 . . . . 1.1499999999999999 108.937 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 43.8 ttp -62.25 -44.64 96.08 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.258 -0.901 . . . . 1.3799999999999999 109.191 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.428 ' O ' ' N ' ' A' ' 27' ' ' ASN . . . -57.52 -39.83 77.43 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.15 -0.969 . . . . 1.1200000000000001 108.822 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.2 -38.02 86.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.478 -0.764 . . . . 1.6599999999999999 110.04 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -70.01 -41.9 73.71 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.042 -1.036 . . . . 1.8100000000000001 110.195 -179.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -95.45 -0.21 52.61 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.062 -1.024 . . . . 0.41999999999999998 109.651 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.428 ' N ' ' O ' ' A' ' 23' ' ' ALA . 20.4 m120 53.17 47.21 24.95 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.365 -0.834 . . . . 0.85999999999999999 110.93 179.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 50.1 mt -113.46 150.74 43.67 Favored Pre-proline 0 N--CA 1.504 2.271 0 O-C-N 121.241 -0.912 . . . . 1.1299999999999999 108.904 178.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -70.34 154.0 65.79 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 121.709 1.606 . . . . 0.97999999999999998 111.257 178.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -43.36 -23.45 0.46 Allowed 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.405 2.07 . . . . 0.81000000000000005 113.456 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 68.1 t -60.05 -50.66 79.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 120.797 -1.189 . . . . 1.0800000000000001 110.061 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 81.5 t -75.49 -40.38 41.54 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 O-C-N 120.932 -1.105 . . . . 1.0700000000000001 110.795 -178.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.04 -50.32 74.2 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 120.97 -1.082 . . . . 1.01 109.026 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -61.66 -39.6 91.97 Favored 'General case' 0 C--N 1.299 -1.612 0 O-C-N 121.313 -0.867 . . . . 1.9299999999999999 109.406 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -60.0 -40.06 87.88 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.241 -0.912 . . . . 1.1000000000000001 109.587 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 97.4 mt -62.16 -42.1 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.143 -0.973 . . . . 1.0700000000000001 108.891 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.8 t -65.13 -39.95 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 N-CA-C 108.328 -0.99 . . . . 1.1100000000000001 108.328 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.614 ' O ' ' NE2' ' A' ' 44' ' ' GLN . . . -62.44 -16.47 55.33 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 116.137 -0.483 . . . . 1.1699999999999999 110.838 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 63.6 m -95.89 -37.49 10.68 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.789 -1.195 . . . . 1.0800000000000001 108.301 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 19.0 t -59.99 131.31 50.46 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 107.641 -1.244 . . . . 0.5 107.641 178.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -77.55 -29.12 52.06 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.906 -1.121 . . . . 1.52 110.938 -178.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 30.9 mttt -76.44 -42.07 45.23 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.894 -1.129 . . . . 2.5299999999999998 110.992 -178.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 71.5 m -80.05 -9.97 59.73 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.873 -1.142 . . . . 0.68000000000000005 109.642 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.614 ' NE2' ' O ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -73.51 -66.47 0.69 Allowed 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.194 -0.941 . . . . 1.6599999999999999 108.761 179.395 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 82.4 mt -82.6 146.3 29.22 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.766 -0.827 . . . . 1.55 108.766 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.1 mttp . . . . . 0 N--CA 1.49 1.529 0 O-C-N 121.251 -0.906 . . . . 4.0099999999999998 108.968 179.525 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 N--CA 1.488 1.465 0 CA-C-O 121.62 0.724 . . . . 1.3100000000000001 109.075 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 65.4 mt -104.28 145.45 30.22 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-O 121.967 0.889 . . . . 1.1299999999999999 111.19 -178.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.517 ' O ' ' N ' ' B' ' 5' ' ' ILE . 46.6 m-20 -60.0 -39.22 85.04 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 107.949 -1.13 . . . . 2.1600000000000001 107.949 178.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' GLY . . . . . . . . . . . . . . . -46.24 -15.68 0.14 Allowed Glycine 0 N--CA 1.493 2.45 0 N-CA-C 109.258 -1.537 . . . . 0.62 109.258 179.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.517 ' N ' ' O ' ' B' ' 3' ' ' ASP . 82.9 mt -60.0 -39.96 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.163 -1.198 . . . . 1.0800000000000001 108.32 178.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.24 -39.72 83.67 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 107.926 -1.139 . . . . 2.0499999999999998 107.926 179.206 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 10.5 tttm -62.73 -40.02 95.9 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.572 0.701 . . . . 2.8500000000000001 109.479 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.54 -35.43 77.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.549 -0.719 . . . . 1.04 110.285 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -60.09 -39.97 87.96 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.991 -1.068 . . . . 1.46 108.948 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -61.42 -39.95 92.64 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.704 -0.622 . . . . 2.4300000000000002 110.018 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -95.93 6.62 48.44 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.174 -0.954 . . . . 2.0899999999999999 110.299 -178.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' CYS . . . . . . . . . . . . . 52.3 t -51.07 -41.83 60.18 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.012 -1.055 . . . . 0.40999999999999998 108.474 178.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . 0.61 ' O ' ' ND1' ' B' ' 16' ' ' HIS . 5.5 mt-10 -60.01 -35.97 76.19 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.867 -0.79 . . . . 2.1000000000000001 108.867 179.012 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 33.2 tttm -64.96 -39.5 93.59 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.61 -0.681 . . . . 2.9300000000000002 110.309 -178.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -85.48 -12.2 52.41 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.037 -1.039 . . . . 1.1200000000000001 109.571 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . 0.677 ' HD1' ' N ' ' B' ' 16' ' ' HIS . 0.1 OUTLIER 57.81 -134.73 1.09 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.393 -0.817 . . . . 2.23 109.919 179.263 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.63 -3.89 58.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.655 -0.653 . . . . 1.8600000000000001 109.663 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -80.28 76.51 7.07 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.013 -1.054 . . . . 0.73999999999999999 109.781 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 69.6 p-90 -70.02 -26.65 64.15 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.322 -0.861 . . . . 0.56999999999999995 109.502 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -60.0 -41.02 91.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.296 -0.878 . . . . 2.1800000000000002 110.284 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.99 -42.01 90.34 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.098 -1.002 . . . . 1.24 108.926 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 43.9 ttp -62.28 -44.54 96.3 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.277 -0.889 . . . . 1.3700000000000001 109.245 179.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . 0.419 ' O ' ' N ' ' B' ' 27' ' ' ASN . . . -57.65 -39.73 77.68 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.104 -0.998 . . . . 1.1200000000000001 108.84 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.22 -38.02 86.95 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.474 -0.766 . . . . 1.5900000000000001 110.05 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -69.99 -41.87 73.81 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.997 -1.065 . . . . 1.8200000000000001 110.189 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -95.49 -0.2 52.5 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.027 -1.046 . . . . 0.45000000000000001 109.641 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' ASN . . . . . 0.419 ' N ' ' O ' ' B' ' 23' ' ' ALA . 20.4 m120 53.24 47.14 25.02 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.317 -0.865 . . . . 0.84999999999999998 110.939 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 50.0 mt -113.38 150.72 43.58 Favored Pre-proline 0 N--CA 1.505 2.276 0 O-C-N 121.234 -0.916 . . . . 1.1299999999999999 108.896 179.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -70.33 154.05 65.8 Favored 'Trans proline' 0 N--CA 1.489 1.216 0 C-N-CA 121.743 1.629 . . . . 1.0 111.266 178.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -43.41 -23.44 0.47 Allowed 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 122.417 2.078 . . . . 0.80000000000000004 113.489 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 68.5 t -60.03 -50.67 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 O-C-N 120.77 -1.206 . . . . 1.1299999999999999 110.065 -178.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 80.7 t -75.5 -40.41 41.51 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.552 0 O-C-N 120.837 -1.164 . . . . 1.0700000000000001 110.783 -178.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.95 -50.33 74.18 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 120.933 -1.105 . . . . 1.0 109.075 -179.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -61.72 -39.6 92.09 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.378 -0.827 . . . . 1.95 109.41 179.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -60.0 -39.99 87.7 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.219 -0.925 . . . . 1.1100000000000001 109.56 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 97.4 mt -62.23 -42.03 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.145 -0.972 . . . . 1.0600000000000001 108.917 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 48.7 t -65.17 -40.04 87.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 N-CA-C 108.293 -1.003 . . . . 1.1399999999999999 108.293 178.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' ALA . . . . . 0.455 ' O ' ' OE1' ' B' ' 44' ' ' GLN . . . -62.17 -17.1 57.04 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.88 -0.512 . . . . 1.21 110.895 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 65.0 m -95.4 -37.41 10.95 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.901 -1.125 . . . . 1.1399999999999999 108.434 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' CYS . . . . . . . . . . . . . 19.1 t -60.03 131.31 50.44 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 107.654 -1.239 . . . . 0.5 107.654 178.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -77.52 -29.17 52.29 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.87 -1.144 . . . . 1.54 110.953 -178.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 30.8 mttt -76.37 -42.13 45.71 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.923 -1.111 . . . . 2.5899999999999999 111.042 -178.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 71.4 m -79.97 -10.03 59.74 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.849 -1.157 . . . . 0.71999999999999997 109.658 -179.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . 0.455 ' OE1' ' O ' ' B' ' 38' ' ' ALA . 3.9 tp60 -73.52 -66.42 0.7 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.131 -0.981 . . . . 1.72 108.702 179.455 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 82.3 mt -82.62 146.28 29.21 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 108.831 -0.803 . . . . 1.55 108.831 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 28.1 mttp . . . . . 0 N--CA 1.489 1.482 0 O-C-N 121.233 -0.917 . . . . 4.0199999999999996 108.968 179.543 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 9.6 m-85 . . . . . 0 N--CA 1.489 1.485 0 CA-C-O 121.594 0.711 . . . . 0.77000000000000002 109.139 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 65.5 mt -104.35 145.44 30.25 Favored 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 121.966 0.889 . . . . 0.46999999999999997 111.187 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.516 ' O ' ' N ' ' A' ' 5' ' ' ILE . 46.5 m-20 -59.96 -39.2 84.8 Favored 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 107.942 -1.132 . . . . 2.1299999999999999 107.942 178.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -46.32 -15.63 0.14 Allowed Glycine 0 N--CA 1.494 2.509 0 N-CA-C 109.224 -1.55 . . . . 0.55000000000000004 109.224 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.516 ' N ' ' O ' ' A' ' 3' ' ' ASP . 83.0 mt -60.07 -39.99 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.068 -1.254 . . . . 0.34000000000000002 108.298 178.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.28 -39.65 83.61 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 107.912 -1.144 . . . . 2.0899999999999999 107.912 179.196 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.6 tttm -62.75 -40.03 95.97 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-O 121.619 0.723 . . . . 2.3900000000000001 109.477 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.53 -35.53 78.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.527 -0.733 . . . . 0.29999999999999999 110.28 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -59.96 -39.98 87.47 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.948 -1.095 . . . . 1.0800000000000001 108.966 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -61.44 -39.99 92.86 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.633 -0.667 . . . . 2.3999999999999999 110.031 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -95.87 6.62 48.46 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.234 -0.916 . . . . 2.0099999999999998 110.288 -178.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 52.2 t -51.05 -41.85 60.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.977 -1.077 . . . . 0.40000000000000002 108.455 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.609 ' O ' ' ND1' ' A' ' 16' ' ' HIS . 5.5 mt-10 -60.03 -35.98 76.29 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.9 -0.778 . . . . 2.1099999999999999 108.9 179.031 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -64.93 -39.53 93.64 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.587 -0.696 . . . . 2.3700000000000001 110.275 -178.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -85.48 -12.11 52.63 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.1 -1.0 . . . . 0.58999999999999997 109.629 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.609 ' ND1' ' O ' ' A' ' 13' ' ' GLU . 0.1 OUTLIER 57.74 -134.69 1.1 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.4 -0.813 . . . . 1.3 109.929 179.234 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.68 -3.88 58.75 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.692 -0.63 . . . . 1.4399999999999999 109.634 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -80.28 76.46 7.07 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.05 -1.031 . . . . 0.69999999999999996 109.807 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 69.6 p-90 -69.98 -26.64 64.18 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.349 -0.844 . . . . 0.44 109.519 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -60.05 -40.97 91.28 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.302 -0.873 . . . . 1.6899999999999999 110.257 -179.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.03 -41.97 90.23 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.144 -0.972 . . . . 0.41999999999999998 108.937 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 43.8 ttp -62.25 -44.64 96.08 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.258 -0.901 . . . . 0.83999999999999997 109.191 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.428 ' O ' ' N ' ' A' ' 27' ' ' ASN . . . -57.52 -39.83 77.43 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.15 -0.969 . . . . 0.34999999999999998 108.822 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.2 -38.02 86.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.478 -0.764 . . . . 1.22 110.04 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -70.01 -41.9 73.71 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.042 -1.036 . . . . 1.8100000000000001 110.195 -179.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -95.45 -0.21 52.61 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.062 -1.024 . . . . 0.39000000000000001 109.651 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.428 ' N ' ' O ' ' A' ' 23' ' ' ALA . 82.9 m-20 53.17 47.21 24.95 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.365 -0.834 . . . . 0.75 110.93 179.099 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.494 HD13 HG11 ' A' ' 32' ' ' VAL . 50.1 mt -113.46 150.74 43.67 Favored Pre-proline 0 N--CA 1.504 2.271 0 O-C-N 121.241 -0.912 . . . . 0.46000000000000002 108.904 178.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -70.34 154.0 65.79 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 121.709 1.606 . . . . 0.63 111.257 178.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -43.36 -23.45 0.46 Allowed 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.405 2.07 . . . . 0.53000000000000003 113.456 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 68.1 t -60.05 -50.66 79.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 120.797 -1.189 . . . . 0.28999999999999998 110.061 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.494 HG11 HD13 ' A' ' 28' ' ' LEU . 81.5 t -75.49 -40.38 41.54 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 O-C-N 120.932 -1.105 . . . . 0.26000000000000001 110.795 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.04 -50.32 74.2 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 120.97 -1.082 . . . . 0.23000000000000001 109.026 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -61.66 -39.6 91.97 Favored 'General case' 0 C--N 1.299 -1.612 0 O-C-N 121.313 -0.867 . . . . 1.3999999999999999 109.406 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -60.0 -40.06 87.88 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.241 -0.912 . . . . 1.1000000000000001 109.587 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 97.4 mt -62.16 -42.1 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.143 -0.973 . . . . 0.23000000000000001 108.891 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.8 t -65.13 -39.95 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 N-CA-C 108.328 -0.99 . . . . 0.34999999999999998 108.328 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.614 ' O ' ' NE2' ' A' ' 44' ' ' GLN . . . -62.44 -16.47 55.33 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 116.137 -0.483 . . . . 0.48999999999999999 110.838 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 63.6 m -95.89 -37.49 10.68 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.789 -1.195 . . . . 0.64000000000000001 108.301 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 19.0 t -59.99 131.31 50.46 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 107.641 -1.244 . . . . 0.48999999999999999 107.641 178.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -77.55 -29.12 52.06 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.906 -1.121 . . . . 1.52 110.938 -178.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 30.9 mttt -76.44 -42.07 45.23 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.894 -1.129 . . . . 2.0499999999999998 110.992 -178.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 71.5 m -80.05 -9.97 59.73 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.873 -1.142 . . . . 0.68000000000000005 109.642 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.614 ' NE2' ' O ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -73.51 -66.47 0.69 Allowed 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.194 -0.941 . . . . 1.1000000000000001 108.761 179.395 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 82.4 mt -82.6 146.3 29.22 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.766 -0.827 . . . . 1.05 108.766 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.1 mttp . . . . . 0 N--CA 1.49 1.529 0 O-C-N 121.251 -0.906 . . . . 3.5600000000000001 108.968 179.525 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 N--CA 1.488 1.465 0 CA-C-O 121.62 0.724 . . . . 0.77000000000000002 109.075 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 65.4 mt -104.28 145.45 30.22 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-O 121.967 0.889 . . . . 0.46999999999999997 111.19 -178.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.517 ' O ' ' N ' ' B' ' 5' ' ' ILE . 46.6 m-20 -60.0 -39.22 85.04 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 107.949 -1.13 . . . . 2.1600000000000001 107.949 178.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 4' ' ' GLY . . . . . . . . . . . . . . . -46.24 -15.68 0.14 Allowed Glycine 0 N--CA 1.493 2.45 0 N-CA-C 109.258 -1.537 . . . . 0.55000000000000004 109.258 179.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.517 ' N ' ' O ' ' B' ' 3' ' ' ASP . 82.9 mt -60.0 -39.96 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.163 -1.198 . . . . 0.34999999999999998 108.32 178.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.24 -39.72 83.67 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 107.926 -1.139 . . . . 2.0499999999999998 107.926 179.206 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 10.5 tttm -62.73 -40.02 95.9 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.572 0.701 . . . . 2.4199999999999999 109.479 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.54 -35.43 77.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.549 -0.719 . . . . 0.28999999999999998 110.285 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -60.09 -39.97 87.96 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.991 -1.068 . . . . 1.03 108.948 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -61.42 -39.95 92.64 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.704 -0.622 . . . . 2.4300000000000002 110.018 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -95.93 6.62 48.44 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.174 -0.954 . . . . 2.0899999999999999 110.299 -178.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' CYS . . . . . . . . . . . . . 52.3 t -51.07 -41.83 60.18 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.012 -1.055 . . . . 0.39000000000000001 108.474 178.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' GLU . . . . . 0.61 ' O ' ' ND1' ' B' ' 16' ' ' HIS . 5.5 mt-10 -60.01 -35.97 76.19 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.867 -0.79 . . . . 2.1000000000000001 108.867 179.012 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 33.2 tttm -64.96 -39.5 93.59 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.61 -0.681 . . . . 2.4700000000000002 110.309 -178.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -85.48 -12.2 52.41 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.037 -1.039 . . . . 0.60999999999999999 109.571 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' HIS . . . . . 0.61 ' ND1' ' O ' ' B' ' 13' ' ' GLU . 0.1 OUTLIER 57.81 -134.73 1.09 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.393 -0.817 . . . . 1.29 109.919 179.263 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.63 -3.89 58.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.655 -0.653 . . . . 1.4399999999999999 109.663 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 18' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -80.28 76.51 7.07 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.013 -1.054 . . . . 0.68000000000000005 109.781 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 69.6 p-90 -70.02 -26.65 64.15 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.322 -0.861 . . . . 0.51000000000000001 109.502 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -60.0 -41.02 91.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.296 -0.878 . . . . 1.74 110.284 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.99 -42.01 90.34 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.098 -1.002 . . . . 0.48999999999999999 108.926 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 43.9 ttp -62.28 -44.54 96.3 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.277 -0.889 . . . . 0.84999999999999998 109.245 179.19 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.419 ' O ' ' N ' ' B' ' 27' ' ' ASN . . . -57.65 -39.73 77.68 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.104 -0.998 . . . . 0.37 108.84 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.22 -38.02 86.95 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.474 -0.766 . . . . 1.2 110.05 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -69.99 -41.87 73.81 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.997 -1.065 . . . . 1.8200000000000001 110.189 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -95.49 -0.2 52.5 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.027 -1.046 . . . . 0.40999999999999998 109.641 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' ASN . . . . . 0.419 ' N ' ' O ' ' B' ' 23' ' ' ALA . 82.8 m-20 53.24 47.14 25.02 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.317 -0.865 . . . . 0.73999999999999999 110.939 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 28' ' ' LEU . . . . . 0.493 HD13 HG11 ' B' ' 32' ' ' VAL . 50.0 mt -113.38 150.72 43.58 Favored Pre-proline 0 N--CA 1.505 2.276 0 O-C-N 121.234 -0.916 . . . . 0.42999999999999999 108.896 179.044 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 29' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -70.33 154.05 65.8 Favored 'Trans proline' 0 N--CA 1.489 1.216 0 C-N-CA 121.743 1.629 . . . . 0.64000000000000001 111.266 178.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -43.41 -23.44 0.47 Allowed 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 122.417 2.078 . . . . 0.53000000000000003 113.489 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 68.5 t -60.03 -50.67 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 O-C-N 120.77 -1.206 . . . . 0.29999999999999999 110.065 -178.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.493 HG11 HD13 ' B' ' 28' ' ' LEU . 80.7 t -75.5 -40.41 41.51 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.552 0 O-C-N 120.837 -1.164 . . . . 0.26000000000000001 110.783 -178.546 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.95 -50.33 74.18 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 120.933 -1.105 . . . . 0.23000000000000001 109.075 -179.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -61.72 -39.6 92.09 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.378 -0.827 . . . . 1.4399999999999999 109.41 179.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -60.0 -39.99 87.7 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.219 -0.925 . . . . 1.1100000000000001 109.56 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 97.4 mt -62.23 -42.03 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.145 -0.972 . . . . 0.23999999999999999 108.917 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 48.7 t -65.17 -40.04 87.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 N-CA-C 108.293 -1.003 . . . . 0.37 108.293 178.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 38' ' ' ALA . . . . . 0.455 ' O ' ' OE1' ' B' ' 44' ' ' GLN . . . -62.17 -17.1 57.04 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.88 -0.512 . . . . 0.52000000000000002 110.895 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 65.0 m -95.4 -37.41 10.95 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.901 -1.125 . . . . 0.65000000000000002 108.434 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 40' ' ' CYS . . . . . . . . . . . . . 19.1 t -60.03 131.31 50.44 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 107.654 -1.239 . . . . 0.48999999999999999 107.654 178.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 41' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -77.52 -29.17 52.29 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.87 -1.144 . . . . 1.54 110.953 -178.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 30.8 mttt -76.37 -42.13 45.71 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.923 -1.111 . . . . 2.0899999999999999 111.042 -178.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 71.4 m -79.97 -10.03 59.74 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.849 -1.157 . . . . 0.71999999999999997 109.658 -179.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' GLN . . . . . 0.455 ' OE1' ' O ' ' B' ' 38' ' ' ALA . 3.9 tp60 -73.52 -66.42 0.7 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.131 -0.981 . . . . 1.1699999999999999 108.702 179.455 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 82.3 mt -82.62 146.28 29.21 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 108.831 -0.803 . . . . 1.0700000000000001 108.831 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 28.1 mttp . . . . . 0 N--CA 1.489 1.482 0 O-C-N 121.233 -0.917 . . . . 3.5800000000000001 108.968 179.543 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 56' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 9.6 m-85 . . . . . 0 N--CA 1.489 1.485 0 CA-C-O 121.594 0.711 . . . . 0.77000000000000002 109.139 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 65.5 mt -104.35 145.44 30.25 Favored 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 121.966 0.889 . . . . 0.46999999999999997 111.187 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.516 ' O ' ' N ' ' A' ' 5' ' ' ILE . 46.5 m-20 -59.96 -39.2 84.8 Favored 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 107.942 -1.132 . . . . 2.1299999999999999 107.942 178.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -46.32 -15.63 0.14 Allowed Glycine 0 N--CA 1.494 2.509 0 N-CA-C 109.224 -1.55 . . . . 0.55000000000000004 109.224 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.516 ' N ' ' O ' ' A' ' 3' ' ' ASP . 83.0 mt -60.07 -39.99 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.068 -1.254 . . . . 0.34000000000000002 108.298 178.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.28 -39.65 83.61 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 107.912 -1.144 . . . . 2.0899999999999999 107.912 179.196 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.6 tttm -62.75 -40.03 95.97 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-O 121.619 0.723 . . . . 2.3900000000000001 109.477 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.53 -35.53 78.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.527 -0.733 . . . . 0.29999999999999999 110.28 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -59.96 -39.98 87.47 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.948 -1.095 . . . . 1.0800000000000001 108.966 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -61.44 -39.99 92.86 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.633 -0.667 . . . . 2.3999999999999999 110.031 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -95.87 6.62 48.46 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.234 -0.916 . . . . 2.0099999999999998 110.288 -178.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 52.2 t -51.05 -41.85 60.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.977 -1.077 . . . . 0.40000000000000002 108.455 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.609 ' O ' ' ND1' ' A' ' 16' ' ' HIS . 5.5 mt-10 -60.03 -35.98 76.29 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.9 -0.778 . . . . 2.1099999999999999 108.9 179.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -64.93 -39.53 93.64 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.587 -0.696 . . . . 2.3700000000000001 110.275 -178.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -85.48 -12.11 52.63 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.1 -1.0 . . . . 0.58999999999999997 109.629 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.609 ' ND1' ' O ' ' A' ' 13' ' ' GLU . 0.1 OUTLIER 57.74 -134.69 1.1 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.4 -0.813 . . . . 1.3 109.929 179.234 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.68 -3.88 58.75 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.692 -0.63 . . . . 1.4399999999999999 109.634 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -80.28 76.46 7.07 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.05 -1.031 . . . . 0.69999999999999996 109.807 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 69.6 p-90 -69.98 -26.64 64.18 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.349 -0.844 . . . . 0.44 109.519 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -60.05 -40.97 91.28 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.302 -0.873 . . . . 1.6899999999999999 110.257 -179.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.03 -41.97 90.23 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.144 -0.972 . . . . 0.41999999999999998 108.937 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 43.8 ttp -62.25 -44.64 96.08 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.258 -0.901 . . . . 0.83999999999999997 109.191 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.428 ' O ' ' N ' ' A' ' 27' ' ' ASN . . . -57.52 -39.83 77.43 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.15 -0.969 . . . . 0.34999999999999998 108.822 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.2 -38.02 86.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.478 -0.764 . . . . 1.22 110.04 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -70.01 -41.9 73.71 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.042 -1.036 . . . . 1.8100000000000001 110.195 -179.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -95.45 -0.21 52.61 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.062 -1.024 . . . . 0.39000000000000001 109.651 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.428 ' N ' ' O ' ' A' ' 23' ' ' ALA . 20.4 m120 53.17 47.21 24.95 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.365 -0.834 . . . . 0.75 110.93 179.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.494 HD13 HG11 ' A' ' 32' ' ' VAL . 50.1 mt -113.46 150.74 43.67 Favored Pre-proline 0 N--CA 1.504 2.271 0 O-C-N 121.241 -0.912 . . . . 0.46000000000000002 108.904 178.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -70.34 154.0 65.79 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 121.709 1.606 . . . . 0.63 111.257 178.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -43.36 -23.45 0.46 Allowed 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.405 2.07 . . . . 0.53000000000000003 113.456 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 68.1 t -60.05 -50.66 79.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 120.797 -1.189 . . . . 0.28999999999999998 110.061 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.494 HG11 HD13 ' A' ' 28' ' ' LEU . 81.5 t -75.49 -40.38 41.54 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 O-C-N 120.932 -1.105 . . . . 0.26000000000000001 110.795 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.04 -50.32 74.2 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 120.97 -1.082 . . . . 0.23000000000000001 109.026 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -61.66 -39.6 91.97 Favored 'General case' 0 C--N 1.299 -1.612 0 O-C-N 121.313 -0.867 . . . . 1.3999999999999999 109.406 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -60.0 -40.06 87.88 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.241 -0.912 . . . . 1.1000000000000001 109.587 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 97.4 mt -62.16 -42.1 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.143 -0.973 . . . . 0.23000000000000001 108.891 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.8 t -65.13 -39.95 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 N-CA-C 108.328 -0.99 . . . . 0.34999999999999998 108.328 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.614 ' O ' ' NE2' ' A' ' 44' ' ' GLN . . . -62.44 -16.47 55.33 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 116.137 -0.483 . . . . 0.48999999999999999 110.838 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 63.6 m -95.89 -37.49 10.68 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.789 -1.195 . . . . 0.64000000000000001 108.301 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 19.0 t -59.99 131.31 50.46 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 107.641 -1.244 . . . . 0.48999999999999999 107.641 178.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -77.55 -29.12 52.06 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.906 -1.121 . . . . 1.52 110.938 -178.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 30.9 mttt -76.44 -42.07 45.23 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.894 -1.129 . . . . 2.0499999999999998 110.992 -178.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 71.5 m -80.05 -9.97 59.73 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.873 -1.142 . . . . 0.68000000000000005 109.642 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.614 ' NE2' ' O ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -73.51 -66.47 0.69 Allowed 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.194 -0.941 . . . . 1.1000000000000001 108.761 179.395 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 82.4 mt -82.6 146.3 29.22 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.766 -0.827 . . . . 1.05 108.766 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.1 mttp . . . . . 0 N--CA 1.49 1.529 0 O-C-N 121.251 -0.906 . . . . 3.5600000000000001 108.968 179.525 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 N--CA 1.488 1.465 0 CA-C-O 121.62 0.724 . . . . 0.77000000000000002 109.075 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 65.4 mt -104.28 145.45 30.22 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-O 121.967 0.889 . . . . 0.46999999999999997 111.19 -178.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.517 ' O ' ' N ' ' B' ' 5' ' ' ILE . 46.6 m-20 -60.0 -39.22 85.04 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 107.949 -1.13 . . . . 2.1600000000000001 107.949 178.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' GLY . . . . . . . . . . . . . . . -46.24 -15.68 0.14 Allowed Glycine 0 N--CA 1.493 2.45 0 N-CA-C 109.258 -1.537 . . . . 0.55000000000000004 109.258 179.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.517 ' N ' ' O ' ' B' ' 3' ' ' ASP . 82.9 mt -60.0 -39.96 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.163 -1.198 . . . . 0.34999999999999998 108.32 178.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.24 -39.72 83.67 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 107.926 -1.139 . . . . 2.0499999999999998 107.926 179.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 10.5 tttm -62.73 -40.02 95.9 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.572 0.701 . . . . 2.4199999999999999 109.479 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.54 -35.43 77.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.549 -0.719 . . . . 0.28999999999999998 110.285 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -60.09 -39.97 87.96 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.991 -1.068 . . . . 1.03 108.948 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -61.42 -39.95 92.64 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.704 -0.622 . . . . 2.4300000000000002 110.018 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -95.93 6.62 48.44 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.174 -0.954 . . . . 2.0899999999999999 110.299 -178.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' CYS . . . . . . . . . . . . . 52.3 t -51.07 -41.83 60.18 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.012 -1.055 . . . . 0.39000000000000001 108.474 178.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . 0.61 ' O ' ' ND1' ' B' ' 16' ' ' HIS . 5.5 mt-10 -60.01 -35.97 76.19 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.867 -0.79 . . . . 2.1000000000000001 108.867 179.012 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 33.2 tttm -64.96 -39.5 93.59 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.61 -0.681 . . . . 2.4700000000000002 110.309 -178.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -85.48 -12.2 52.41 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.037 -1.039 . . . . 0.60999999999999999 109.571 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . 0.61 ' ND1' ' O ' ' B' ' 13' ' ' GLU . 0.1 OUTLIER 57.81 -134.73 1.09 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.393 -0.817 . . . . 1.29 109.919 179.263 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.63 -3.89 58.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.655 -0.653 . . . . 1.4399999999999999 109.663 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -80.28 76.51 7.07 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.013 -1.054 . . . . 0.68000000000000005 109.781 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 69.6 p-90 -70.02 -26.65 64.15 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.322 -0.861 . . . . 0.51000000000000001 109.502 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -60.0 -41.02 91.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.296 -0.878 . . . . 1.74 110.284 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.99 -42.01 90.34 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.098 -1.002 . . . . 0.48999999999999999 108.926 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 43.9 ttp -62.28 -44.54 96.3 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.277 -0.889 . . . . 0.84999999999999998 109.245 179.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.419 ' O ' ' N ' ' B' ' 27' ' ' ASN . . . -57.65 -39.73 77.68 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.104 -0.998 . . . . 0.37 108.84 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.22 -38.02 86.95 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.474 -0.766 . . . . 1.2 110.05 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -69.99 -41.87 73.81 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.997 -1.065 . . . . 1.8200000000000001 110.189 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -95.49 -0.2 52.5 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.027 -1.046 . . . . 0.40999999999999998 109.641 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' ASN . . . . . 0.419 ' N ' ' O ' ' B' ' 23' ' ' ALA . 20.4 m120 53.24 47.14 25.02 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.317 -0.865 . . . . 0.73999999999999999 110.939 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' LEU . . . . . 0.493 HD13 HG11 ' B' ' 32' ' ' VAL . 50.0 mt -113.38 150.72 43.58 Favored Pre-proline 0 N--CA 1.505 2.276 0 O-C-N 121.234 -0.916 . . . . 0.42999999999999999 108.896 179.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -70.33 154.05 65.8 Favored 'Trans proline' 0 N--CA 1.489 1.216 0 C-N-CA 121.743 1.629 . . . . 0.64000000000000001 111.266 178.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -43.41 -23.44 0.47 Allowed 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 122.417 2.078 . . . . 0.53000000000000003 113.489 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 68.5 t -60.03 -50.67 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 O-C-N 120.77 -1.206 . . . . 0.29999999999999999 110.065 -178.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.493 HG11 HD13 ' B' ' 28' ' ' LEU . 80.7 t -75.5 -40.41 41.51 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.552 0 O-C-N 120.837 -1.164 . . . . 0.26000000000000001 110.783 -178.546 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.95 -50.33 74.18 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 120.933 -1.105 . . . . 0.23000000000000001 109.075 -179.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -61.72 -39.6 92.09 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.378 -0.827 . . . . 1.4399999999999999 109.41 179.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -60.0 -39.99 87.7 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.219 -0.925 . . . . 1.1100000000000001 109.56 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 97.4 mt -62.23 -42.03 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.145 -0.972 . . . . 0.23999999999999999 108.917 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 48.7 t -65.17 -40.04 87.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 N-CA-C 108.293 -1.003 . . . . 0.37 108.293 178.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' ALA . . . . . 0.455 ' O ' ' OE1' ' B' ' 44' ' ' GLN . . . -62.17 -17.1 57.04 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.88 -0.512 . . . . 0.52000000000000002 110.895 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 65.0 m -95.4 -37.41 10.95 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.901 -1.125 . . . . 0.65000000000000002 108.434 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' CYS . . . . . . . . . . . . . 19.1 t -60.03 131.31 50.44 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 107.654 -1.239 . . . . 0.48999999999999999 107.654 178.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -77.52 -29.17 52.29 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.87 -1.144 . . . . 1.54 110.953 -178.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 30.8 mttt -76.37 -42.13 45.71 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.923 -1.111 . . . . 2.0899999999999999 111.042 -178.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 71.4 m -79.97 -10.03 59.74 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.849 -1.157 . . . . 0.71999999999999997 109.658 -179.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . 0.455 ' OE1' ' O ' ' B' ' 38' ' ' ALA . 3.9 tp60 -73.52 -66.42 0.7 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.131 -0.981 . . . . 1.1699999999999999 108.702 179.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 82.3 mt -82.62 146.28 29.21 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 108.831 -0.803 . . . . 1.0700000000000001 108.831 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 28.1 mttp . . . . . 0 N--CA 1.489 1.482 0 O-C-N 121.233 -0.917 . . . . 3.5800000000000001 108.968 179.543 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_